0 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.17 BrCCCc1cc[n]cc1 Amb24094393 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.17 BrCCOc1cccc[n]1 Amb25808972 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.17 Br[Mg]C#Cc1ccccc1 Amb22353480 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.17 Br[Zn]C#Cc1ccccc1 Amb22898101 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.17 Br\C=N/Nc1ccccc1 Amb25783866 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.17 Br\C=N\Nc1ccccc1 Amb25274154 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|1,0,3]=4 15 B10R1.17 C#CCCc1c[n]ccc1 Amb24085226 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.17 C#CCCc1cc[n]cc1 Amb24091331 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.17 C#CCCc1cccc[n]1 Amb24571654 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.17 C#CCNc1[n]ccc[n]1 Amb18958802 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.17 C#CCNc1c[n]c[n]c1 Amb25251385 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.17 C#CCNc1c[n]cc[n]1 Amb18284772 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.17 C#CCNc1c[n]ccc1 Amb24752597 [0,0,0,0,0,0|1,0,2]=3 22 B10R1.17 C#CCNc1cc[n]c[n]1 Amb18959031 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.17 C#CCNc1cc[n]cc1 Amb18284709 [0,0,0,0,0,0|1,0,2]=3 24 B10R1.17 C#CCNc1ccc[n][n]1 Amb18286133 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.17 C#CCNc1cccc[n]1 Amb18959521 [0,0,0,0,0,0|1,0,2]=3 26 B10R1.17 C#CCNc1ccccc1 Amb21953889 [0,0,0,0,0,0|0,0,2]=2 27 B10R1.17 C#CCOc1c[n]ccc1 Amb22586592 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.17 C#CCOc1cc[n]cc1 Amb24117045 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.17 C#CCOc1cccc[n]1 Amb24407701 [0,0,0,0,0,0|2,0,2]=4 30 B10R1.17 C#CCSc1cccc[n]1 Amb24070203 [0,0,0,0,0,0|2,0,2]=4 31 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [0,0,0,0,0,0|1,0,3]=4 32 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|1,0,2]=3 35 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|1,0,1]=2 36 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.17 C=CCNc1c[n]cc[n]1 Amb18985579 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.17 C=CCNc1cc[n]c[n]1 Amb18295586 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.17 C=CCNc1cc[n]cc1 Amb18986519 [0,0,0,0,0,0|1,0,0]=1 42 B10R1.17 C=CCNc1ccc[n][n]1 Amb18298719 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.17 C=CCNc1ncccn1 Amb2439058 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.17 C=CCOc1[n]ccc[n]1 Amb24101156 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.17 C=CCOc1c[n]c[n]c1 Amb24098642 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.17 C=CCOc1cc[n]cc1 Amb25234559 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.17 C=CCSc1c[n]cc[n]1 Amb25859620 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.17 C=CCSc1cc[n]cc1 Amb25725359 [0,0,0,0,0,0|2,0,0]=2 49 B10R1.17 C=CCSc1ncccn1 Amb10564170 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.17 C=CC[Se]c1cccc[n]1 Amb24101157 [0,0,0,0,0,0|2,0,0]=2 51 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [0,0,0,0,0,0|1,0,0]=1 52 B10R1.17 C=CNCc1ccccc1 Amb24505107 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.17 C=C\C=C/c1cccc[n]1 Amb25697110 [0,0,0,0,0,0|2,0,1]=3 55 B10R1.17 C=C\C=C\c1cccc[n]1 Amb24101872 [0,0,0,0,0,0|2,0,1]=3 56 B10R1.17 C=NOCc1ccccc1 Amb24704253 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.17 CC#COc1ccccc1 Amb25146348 [0,0,0,0,0,0|1,0,3]=4 58 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [0,0,0,0,0,0|1,0,3]=4 59 B10R1.17 CCCCc1ccccn1 Amb10574134 [0,0,0,0,0,0|2,0,2]=4 60 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|2,0,2]=4 61 B10R1.17 CCCNc1c[n][n]cc1 Amb23559651 [0,0,0,0,0,0|2,0,2]=4 62 B10R1.17 CCCNc1cc[n]c[n]1 Amb18973881 [0,0,0,0,0,0|2,0,2]=4 63 B10R1.17 CCCNc1ccc[n][n]1 Amb18991535 [0,0,0,0,0,0|2,0,2]=4 64 B10R1.17 CCCNc1ccccc1 Amb22284540 [0,0,0,0,0,0|0,0,2]=2 65 B10R1.17 CCCOc1c[n]ccc1 Amb25064833 [0,0,0,0,0,0|2,0,2]=4 66 B10R1.17 CCCOc1cccc[n]1 Amb24096899 [0,0,0,0,0,0|2,0,2]=4 67 B10R1.17 CCCSc1cccc[n]1 Amb24733306 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [0,0,0,0,0,0|2,0,2]=4 69 B10R1.17 CCONc1cccc[n]1 Amb25307411 [0,0,0,0,0,0|2,0,2]=4 70 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|2,0,2]=4 71 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [0,0,0,0,0,0|1,0,3]=4 73 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|2,0,1]=3 76 B10R1.17 CNCCc1ccccc1 Amb2119452 [0,0,0,0,0,0|2,0,1]=3 77 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|3,0,1]=4 79 B10R1.17 CNCCc1cccnc1 Amb10576212 [0,0,0,0,0,0|3,0,1]=4 80 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|3,0,1]=4 81 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.17 CNNCc1ccccc1 Amb10553073 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|3,0,1]=4 84 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [0,0,0,0,0,0|1,0,3]=4 85 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|2,0,2]=4 86 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.17 COCCc1cccc[n]1 Amb24089662 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.17 COCNc1ccccc1 Amb10565397 [0,0,0,0,0,0|1,0,1]=2 89 B10R1.17 COCOc1cccnc1 Amb10561791 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.17 COCSc1cccc[n]1 Amb24482838 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.17 CON=Cc1ccccc1 Amb22896936 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|2,0,2]=4 94 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [0,0,0,0,0,0|3,0,1]=4 96 B10R1.17 CSCCc1ccncc1 Amb1864660 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|2,0,1]=3 98 B10R1.17 CSCSc1cccc[n]1 Amb24658343 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.17 CSCSc1ccccc1 Amb25162526 [0,0,0,0,0,0|2,0,1]=3 100 B10R1.17 CSSCc1ccccc1 Amb22230274 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.17 C\C=C/Oc1cccc[n]1 Amb24101907 [0,0,0,0,0,0|2,0,2]=4 102 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [0,0,0,0,0,0|2,0,2]=4 103 B10R1.17 C\C=C\Oc1cccc[n]1 Amb24101879 [0,0,0,0,0,0|2,0,2]=4 104 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [0,0,0,0,0,0|1,0,2]=3 105 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|1,0,2]=3 106 B10R1.17 C\C=N/Nc1[n]ccc[n]1 Amb24101997 [0,0,0,0,0,0|3,0,1]=4 107 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.17 C\C=N\Nc1[n]ccc[n]1 Amb24518401 [0,0,0,0,0,0|3,0,1]=4 109 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [0,0,0,0,0,0|2,0,1]=3 110 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [0,0,0,0,0,0|2,0,1]=3 111 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|2,0,2]=4 112 B10R1.17 ClCCC[n+]1ccccc1 Amb24487853 [0,0,0,0,0,0|3,0,1]=4 113 B10R1.17 ClCCCc1cc[n]cc1 Amb21961566 [0,0,0,0,0,0|3,0,1]=4 114 B10R1.17 ClCCCc1ccccn1 Amb17477793 [0,0,0,0,0,0|3,0,1]=4 115 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|3,0,1]=4 116 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|3,0,1]=4 117 B10R1.17 ClCCNc1c[n]cc[n]1 Amb25256817 [0,0,0,0,0,0|3,0,1]=4 118 B10R1.17 ClCCNc1ccc[n][n]1 Amb25740858 [0,0,0,0,0,0|3,0,1]=4 119 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|1,0,1]=2 120 B10R1.17 ClCCOc1c[n]ccc1 Amb19878080 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.17 ClCCOc1c[n]ccc1 Amb22052586 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.17 ClCCOc1cccc[n]1 Amb25098766 [0,0,0,0,0,0|3,0,1]=4 123 B10R1.17 ClCCPc1ccccc1 Amb24390336 [0,0,0,0,0,0|1,1,1]=3 124 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|3,0,1]=4 125 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [0,0,0,0,0,0|2,1,1]=4 126 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [0,0,0,0,0,0|3,0,0]=3 127 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [0,0,0,0,0,0|3,0,1]=4 128 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [0,0,0,0,0,0|3,0,1]=4 129 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [0,0,0,0,0,0|2,0,1]=3 130 B10R1.17 Cl\C=C\Sc1cccc[n]1 Amb24482148 [0,0,0,0,0,0|3,0,1]=4 131 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|2,0,2]=4 132 B10R1.17 FCCCc1ccccc1 Amb25737014 [0,0,0,0,0,0|2,0,1]=3 133 B10R1.17 FCCNc1c[n]ccc1 Amb24062313 [0,0,0,0,0,0|2,0,1]=3 134 B10R1.17 FCCNc1cc[n]cc1 Amb24099520 [0,0,0,0,0,0|2,0,1]=3 135 B10R1.17 FCCNc1cccc[n]1 Amb24509379 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.17 FCCOc1c[n]ccc1 Amb24750081 [0,0,0,0,0,0|3,0,1]=4 137 B10R1.17 FCCOc1cccc[n]1 Amb24349895 [0,0,0,0,0,0|3,0,1]=4 138 B10R1.17 FCCOc1ccccc1 Amb25350055 [0,0,0,0,0,0|2,0,1]=3 139 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|2,0,1]=3 140 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|2,0,1]=3 141 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|2,0,2]=4 142 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|3,0,1]=4 144 B10R1.17 N#CCNc1[n]ccc[n]1 Amb24701944 [0,0,0,0,0,0|3,0,1]=4 145 B10R1.17 N#CCNc1c[n]ccc1 Amb25757230 [0,0,0,0,0,0|2,0,1]=3 146 B10R1.17 N#CCNc1ccc[n][n]1 Amb24429702 [0,0,0,0,0,0|3,0,1]=4 147 B10R1.17 N#CCNc1cccc[n]1 Amb22052191 [0,0,0,0,0,0|2,0,1]=3 148 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|1,0,1]=2 149 B10R1.17 N#CCOc1ccccn1 Amb2459771 [0,0,0,0,0,0|3,0,1]=4 150 B10R1.17 N#CCOc1cccnc1 Amb17399827 [0,0,0,0,0,0|3,0,1]=4 151 B10R1.17 N#CCSc1cc[n]cc1 Amb25725230 [0,0,0,0,0,0|3,0,1]=4 152 B10R1.17 N#CCSc1ccccn1 Amb2496389 [0,0,0,0,0,0|3,0,1]=4 153 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [0,0,0,0,0,0|3,0,1]=4 154 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|2,0,2]=4 155 B10R1.17 N=COCc1ccccc1 Amb22269902 [0,0,0,0,0,0|3,0,0]=3 156 B10R1.17 N=COCc1ccccc1 Amb24652885 [0,0,0,0,0,0|3,0,0]=3 157 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|2,0,2]=4 158 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|2,0,2]=4 159 B10R1.17 NCCCc1c[n]ccc1 Amb18363942 [0,0,0,0,0,0|3,0,1]=4 160 B10R1.17 NCCCc1cc[n]cc1 Amb22490382 [0,0,0,0,0,0|3,0,1]=4 161 B10R1.17 NCCCc1cc[n]cc1 Amb24099592 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.17 NCCCc1cccc[n]1 Amb21954278 [0,0,0,0,0,0|3,0,1]=4 163 B10R1.17 NCCCc1ccccc1 Amb22490482 [0,0,0,0,0,0|2,0,1]=3 164 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|3,0,1]=4 165 B10R1.17 NCCNc1c[n][n]cc1 Amb25290327 [0,0,0,0,0,0|3,0,1]=4 166 B10R1.17 NCCNc1c[n]c[n]c1 Amb18298014 [0,0,0,0,0,0|3,0,1]=4 167 B10R1.17 NCCNc1cc[n]c[n]1 Amb18973879 [0,0,0,0,0,0|3,0,1]=4 168 B10R1.17 NCCNc1cc[n]cc1 Amb19887545 [0,0,0,0,0,0|2,0,1]=3 169 B10R1.17 NCCNc1ccc[n][n]1 Amb18298689 [0,0,0,0,0,0|3,0,1]=4 170 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|1,0,1]=2 171 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,0,0,0,0,0|2,0,1]=3 172 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,0,0,0,0,0|2,0,1]=3 173 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,0,0,0,0,0|2,0,1]=3 174 B10R1.17 NCCNc1cnccn1 Amb1108614 [0,0,0,0,0,0|3,0,1]=4 175 B10R1.17 NCCNc1ncccn1 Amb1108055 [0,0,0,0,0,0|3,0,1]=4 176 B10R1.17 NCCNc1ncccn1 Amb15740843 [0,0,0,0,0,0|3,0,1]=4 177 B10R1.17 NCCOc1cc[n]cc1 Amb18988858 [0,0,0,0,0,0|3,0,1]=4 178 B10R1.17 NCCOc1cc[n]cc1 Amb22728098 [0,0,0,0,0,0|3,0,1]=4 179 B10R1.17 NCCOc1cc[n]cc1 Amb24182077 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|2,0,1]=3 181 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|2,0,1]=3 182 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,0,0,0,0,0|3,0,1]=4 183 B10R1.17 NCCPc1ccccc1 Amb24482461 [0,0,0,0,0,0|1,1,1]=3 184 B10R1.17 NCCSc1cc[n]cc1 Amb21861873 [0,0,0,0,0,0|3,0,1]=4 185 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,0,0,0,0,0|3,0,1]=4 186 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|2,0,2]=4 187 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|2,0,2]=4 188 B10R1.17 NNC#Cc1ccccc1 Amb24443265 [0,0,0,0,0,0|3,0,1]=4 189 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [0,0,0,0,0,0|4,0,0]=4 190 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [0,0,0,0,0,0|4,0,0]=4 191 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|3,0,0]=3 192 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|3,0,0]=3 193 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [0,0,0,0,0,0|4,0,0]=4 194 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|4,0,0]=4 195 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|4,0,0]=4 196 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [0,0,0,0,0,0|4,0,0]=4 197 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [0,0,0,0,0,0|4,0,0]=4 198 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|3,0,0]=3 199 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|3,0,0]=3 200 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [0,0,0,0,0,0|2,0,0]=2 201 B10R1.17 O=CCNc1ccccc1 Amb24566865 [0,0,0,0,0,0|1,0,0]=1 202 B10R1.17 O=CCOc1c[n]c[n]c1 Amb24083667 [0,0,0,0,0,0|4,0,0]=4 203 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [0,0,0,0,0,0|3,0,0]=3 204 B10R1.17 O=CCOc1cc[n]c[n]1 Amb24478315 [0,0,0,0,0,0|4,0,0]=4 205 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [0,0,0,0,0,0|3,0,0]=3 206 B10R1.17 O=CCSc1[n]ccc[n]1 Amb18799502 [0,0,0,0,0,0|4,0,0]=4 207 B10R1.17 O=CCSc1c[n]cc[n]1 Amb25261998 [0,0,0,0,0,0|4,0,0]=4 208 B10R1.17 O=CCSc1cc[n]c[n]1 Amb25825832 [0,0,0,0,0,0|4,0,0]=4 209 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [0,0,0,0,0,0|3,0,0]=3 210 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [0,0,0,0,0,0|3,0,0]=3 211 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|2,0,0]=2 212 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [0,0,0,0,0,0|4,0,0]=4 213 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|3,0,0]=3 214 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|2,0,1]=3 215 B10R1.17 O=C\C=C\c1cc[n]cc1 Amb24325387 [0,0,0,0,0,0|3,0,1]=4 216 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [0,0,0,0,0,0|3,0,1]=4 217 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [0,0,0,0,0,0|3,0,1]=4 218 B10R1.17 O=C\C=C\c1ccncc1 Amb17334137 [0,0,0,0,0,0|3,0,1]=4 219 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [0,0,0,0,0,0|1,0,2]=3 220 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [0,0,0,0,0,0|3,0,1]=4 221 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [0,0,0,0,0,0|3,0,1]=4 222 B10R1.17 OCCNc1c[n]c[n]c1 Amb18270517 [0,0,0,0,0,0|3,0,1]=4 223 B10R1.17 OCCNc1c[n]ccc1 Amb18266115 [0,0,0,0,0,0|2,0,1]=3 224 B10R1.17 OCCNc1cc[n]c[n]1 Amb18973688 [0,0,0,0,0,0|3,0,1]=4 225 B10R1.17 OCCNc1ccc[n][n]1 Amb18298692 [0,0,0,0,0,0|3,0,1]=4 226 B10R1.17 OCCNc1ccccc1 Amb24065196 [0,0,0,0,0,0|1,0,1]=2 227 B10R1.17 OCCNc1ccccc1 Amb24065197 [0,0,0,0,0,0|1,0,1]=2 228 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|2,0,1]=3 229 B10R1.17 OCCOc1c[n]ccc1 Amb19333986 [0,0,0,0,0,0|3,0,1]=4 230 B10R1.17 OCCOc1cccc[n]1 Amb23598433 [0,0,0,0,0,0|3,0,1]=4 231 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|2,0,1]=3 232 B10R1.17 OCCOc1ccncc1 Amb10552812 [0,0,0,0,0,0|3,0,1]=4 233 B10R1.17 OCCSc1c[n]ccc1 Amb25343843 [0,0,0,0,0,0|3,0,1]=4 234 B10R1.17 OCNCc1ccccc1 Amb24756521 [0,0,0,0,0,0|3,0,1]=4 235 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|3,0,1]=4 236 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [0,0,0,0,0,0|1,0,3]=4 237 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [0,0,0,0,0,0|3,0,1]=4 238 B10R1.17 ONCCc1ccccc1 Amb24117032 [0,0,0,0,0,0|3,0,0]=3 239 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [0,0,0,0,0,0|1,0,2]=3 240 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|3,0,1]=4 241 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|3,0,1]=4 242 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|3,0,1]=4 243 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|3,0,1]=4 244 B10R1.17 SCCNc1[n]ccc[n]1 Amb24509517 [0,0,0,0,0,0|3,0,1]=4 245 B10R1.17 SCCNc1c[n]c[n]c1 Amb24095074 [0,0,0,0,0,0|3,0,1]=4 246 B10R1.17 SCCNc1cccc[n]1 Amb24340493 [0,0,0,0,0,0|2,0,1]=3 247 B10R1.17 SCCNc1ccccc1 Amb24065195 [0,0,0,0,0,0|1,0,1]=2 248 B10R1.17 SCCOc1c[n]ccc1 Amb25741157 [0,0,0,0,0,0|3,0,1]=4 249 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|2,0,1]=3 250 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|2,0,1]=3 251 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|3,0,1]=4 252 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [0,0,0,0,0,0|4,0,0]=4 253 B10R1.17 [NH3+]CC#Cc1ccccc1 Amb10555899 [0,0,0,0,0,0|2,0,2]=4 254 B10R1.17 [SiH3]CCCc1c[n]ccc1 Amb24085247 [0,0,0,0,0,0|2,1,1]=4 255 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|1,1,1]=3 256 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 258 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,1]=4 259 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,1]=4 260 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,1]=4 261 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,1]=4 262 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,1]=4 263 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|1,0,0]=2 264 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 265 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 266 B9R1.8 Br\C=C/c1c[n]ccc1 Amb24085678 [1,0,0,0,0,0|2,0,1]=4 267 B9R1.8 Br\C=C/c1cc[n]cc1 Amb25074029 [1,0,0,0,0,0|2,0,1]=4 268 B9R1.8 Br\C=C/c1cccc[n]1 Amb25200984 [1,0,0,0,0,0|2,0,1]=4 269 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,1]=3 270 B9R1.8 Br\C=C\c1c[n]ccc1 Amb24085662 [1,0,0,0,0,0|2,0,1]=4 271 B9R1.8 Br\C=C\c1cccc[n]1 Amb24546348 [1,0,0,0,0,0|2,0,1]=4 272 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|1,0,2]=4 273 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|1,0,2]=4 274 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|1,0,2]=4 275 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|1,0,2]=4 276 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|1,0,2]=4 277 B9R1.8 C=C=Cc1c[n]ccc1 Amb24102495 [1,0,0,0,0,0|1,0,2]=4 278 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|1,0,0]=2 279 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|1,0,0]=2 280 B9R1.8 C=CCc1c[n]cc[n]1 Amb24365743 [1,0,0,0,0,0|2,0,0]=3 281 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|1,0,0]=2 282 B9R1.8 C=CCc1cc[n]c[n]1 Amb24091172 [1,0,0,0,0,0|2,0,0]=3 283 B9R1.8 C=CNc1c[n]c[n]c1 Amb24063009 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|0,0,0]=1 285 B9R1.8 C=COc1c[n]ccc1 Amb24085952 [1,0,0,0,0,0|2,0,0]=3 286 B9R1.8 C=COc1cc[n]cc1 Amb24091446 [1,0,0,0,0,0|2,0,0]=3 287 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|1,0,0]=2 288 B9R1.8 C=CSc1[n]ccc[n]1 Amb22896416 [1,0,0,0,0,0|3,0,0]=4 289 B9R1.8 C=CSc1c[n]ccc1 Amb24102618 [1,0,0,0,0,0|2,0,0]=3 290 B9R1.8 C=CSc1cc[n]cc1 Amb24070689 [1,0,0,0,0,0|2,0,0]=3 291 B9R1.8 C=C\C=C\1/C=CC=CN1 Amb24691445 [1,0,0,0,0,0|1,0,1]=3 292 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|2,0,0]=3 293 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|1,0,2]=4 294 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|0,0,2]=3 295 B9R1.8 CCNc1c[n][n]cc1 Amb23559704 [1,0,0,0,0,0|2,0,1]=4 296 B9R1.8 CCNc1c[n]c[n]c1 Amb18270553 [1,0,0,0,0,0|2,0,1]=4 297 B9R1.8 CCNc1cc[n]c[n]1 Amb18282107 [1,0,0,0,0,0|2,0,1]=4 298 B9R1.8 CCNc1ccc[n][n]1 Amb18286130 [1,0,0,0,0,0|2,0,1]=4 299 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|0,0,1]=2 300 B9R1.8 CCOc1cccnc1 Amb10573342 [1,0,0,0,0,0|2,0,1]=4 301 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|2,0,1]=4 302 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|2,0,1]=4 303 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|2,0,1]=4 304 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|2,0,1]=4 305 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|2,0,1]=4 306 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|2,0,1]=4 307 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|2,0,1]=4 308 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|2,0,1]=4 309 B9R1.8 CNNc1cccc[n]1 Amb25146742 [1,0,0,0,0,0|2,0,1]=4 310 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|1,0,1]=3 311 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|2,0,1]=4 312 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|2,0,1]=4 313 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|2,0,1]=4 314 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|2,0,1]=4 315 B9R1.8 CONc1c[n]ccc1 Amb25347084 [1,0,0,0,0,0|2,0,1]=4 316 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|1,1,1]=4 317 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|2,0,1]=4 318 B9R1.8 CSNc1cccc[n]1 Amb24072693 [1,0,0,0,0,0|2,0,1]=4 319 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|1,0,1]=3 320 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [1,0,0,0,0,0|1,0,2]=4 321 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [1,0,0,0,0,0|1,0,2]=4 322 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [1,0,0,0,0,0|1,0,2]=4 323 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [1,0,0,0,0,0|1,0,2]=4 324 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [1,0,0,0,0,0|1,0,2]=4 325 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 326 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|1,1,0]=3 327 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,1]=4 328 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,1]=4 329 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,1]=4 330 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,1]=4 331 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,1]=4 332 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|1,0,0]=2 333 B9R1.8 ClCOc1c[n]ccc1 Amb25780203 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,0]=3 335 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|1,1,0]=3 336 B9R1.8 ClCSc1c[n]ccc1 Amb25837457 [1,0,0,0,0,0|3,0,0]=4 337 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|2,0,0]=3 338 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|3,0,0]=4 339 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 340 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 341 B9R1.8 Cl\C=C/c1c[n]ccc1 Amb24085684 [1,0,0,0,0,0|2,0,1]=4 342 B9R1.8 Cl\C=C/c1cc[n]cc1 Amb24103276 [1,0,0,0,0,0|2,0,1]=4 343 B9R1.8 Cl\C=C/c1cccc[n]1 Amb24106765 [1,0,0,0,0,0|2,0,1]=4 344 B9R1.8 Cl\C=C\c1cccc[n]1 Amb24106741 [1,0,0,0,0,0|2,0,1]=4 345 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,1]=3 346 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|1,0,1]=3 347 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 348 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,1]=4 349 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,1]=4 350 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,1]=4 351 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|2,0,0]=3 352 B9R1.8 FCSc1cccc[n]1 Amb24106749 [1,0,0,0,0,0|3,0,0]=4 353 B9R1.8 F\C=C/c1cccc[n]1 Amb24106770 [1,0,0,0,0,0|2,0,1]=4 354 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,1]=3 355 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,1]=4 356 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 357 B9R1.8 I\C=C\c1c[n]ccc1 Amb24628558 [1,0,0,0,0,0|2,0,1]=4 358 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,1]=3 359 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|2,0,1]=4 360 B9R1.8 N#CNc1c[n]ccc1 Amb24634820 [1,0,0,0,0,0|2,0,1]=4 361 B9R1.8 N#CNc1cc[n]cc1 Amb25319718 [1,0,0,0,0,0|2,0,1]=4 362 B9R1.8 N#CNc1cccc[n]1 Amb24088143 [1,0,0,0,0,0|2,0,1]=4 363 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|2,0,1]=4 364 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|1,0,1]=3 365 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|1,0,1]=3 366 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|1,0,1]=3 367 B9R1.8 N=CNc1[n]ccc[n]1 Amb24073528 [1,0,0,0,0,0|3,0,0]=4 368 B9R1.8 N=CNc1cccc[n]1 Amb24073535 [1,0,0,0,0,0|2,0,0]=3 369 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|2,0,1]=4 370 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|2,0,1]=4 371 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|2,0,1]=4 372 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|2,0,1]=4 373 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|1,0,1]=3 374 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,1]=3 375 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|1,0,1]=3 376 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|1,0,1]=3 377 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|1,0,1]=3 378 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,1]=4 379 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,1]=4 380 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,1]=4 381 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,1]=4 382 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|1,0,0]=2 383 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|2,0,0]=3 384 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|2,0,0]=3 385 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|1,0,1]=3 386 B9R1.8 NClNc1cc[n]cc1 Amb25207337 [1,0,0,0,0,0|3,0,0]=4 387 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|3,0,0]=4 388 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 389 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 390 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|3,0,0]=4 391 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 392 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 393 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 394 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 395 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 396 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 397 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|3,0,0]=4 398 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 401 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 402 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|2,0,0]=3 403 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 404 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|1,0,1]=3 405 B9R1.8 N\C=C/c1cc[n]cc1 Amb24068867 [1,0,0,0,0,0|2,0,1]=4 406 B9R1.8 N\C=C\c1cc[n]cc1 Amb24749618 [1,0,0,0,0,0|2,0,1]=4 407 B9R1.8 N\C=C\c1cccc[n]1 Amb24518526 [1,0,0,0,0,0|2,0,1]=4 408 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|1,0,1]=3 409 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|2,0,1]=4 410 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|1,0,2]=4 411 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|1,0,2]=4 412 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [1,0,0,0,0,0|3,0,0]=4 413 B9R1.8 O=CCc1c[n]c[n]c1 Amb24634482 [1,0,0,0,0,0|3,0,0]=4 414 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [1,0,0,0,0,0|3,0,0]=4 415 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [1,0,0,0,0,0|3,0,0]=4 416 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [1,0,0,0,0,0|3,0,0]=4 417 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|2,0,0]=3 418 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|2,0,0]=3 419 B9R1.8 O=CNc1c[n]c[n]c1 Amb24095248 [1,0,0,0,0,0|3,0,0]=4 420 B9R1.8 O=CNc1c[n]cc[n]1 Amb24698276 [1,0,0,0,0,0|3,0,0]=4 421 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [1,0,0,0,0,0|3,0,0]=4 422 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|2,0,0]=3 423 B9R1.8 O=C\C=C/1\C=CC=CN1 Amb24068319 [1,0,0,0,0,0|2,0,1]=4 424 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|2,0,1]=4 425 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|2,0,1]=4 426 B9R1.8 OCNc1[n]ccc[n]1 Amb24068196 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.8 OCNc1cccc[n]1 Amb25066721 [1,0,0,0,0,0|2,0,0]=3 428 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|2,0,0]=3 429 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|3,0,0]=4 430 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|2,0,0]=3 432 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|2,0,1]=4 433 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|1,0,2]=4 434 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,0,2]=4 435 B9R1.8 S=CNc1[n]ccc[n]1 Amb24073532 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.8 S=CNc1cccc[n]1 Amb25785094 [1,0,0,0,0,0|2,0,0]=3 437 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,0,0]=2 438 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|2,0,1]=4 439 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|2,0,1]=4 440 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|2,0,1]=4 441 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 442 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,1]=3 443 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,1]=3 444 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|1,0,1]=3 445 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|2,0,1]=4 446 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|2,0,1]=4 447 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|2,0,1]=4 448 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|0,0,2]=3 449 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 450 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 451 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 452 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|2,0,1]=4 453 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,1]=3 454 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|2,0,1]=4 455 B11R1.1 BrCCCc1ccc(cc1)Br Amb17104577 [0,1,0,0,0,0|2,0,1]=4 456 B11R1.1 BrCCCc1ccc(cc1)C Amb17104554 [0,1,0,0,0,0|2,0,1]=4 457 B11R1.1 BrCCCc1ccc(cc1)Cl Amb17104562 [0,1,0,0,0,0|2,0,1]=4 458 B11R1.1 BrCCCc1ccc(cc1)F Amb17104556 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.1 BrCCOc1ccc(cc1)Br Amb1106775 [0,1,0,0,0,0|2,0,1]=4 460 B11R1.1 BrCCOc1ccc(cc1)C Amb1397755 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.1 BrCCOc1ccc(cc1)Cl Amb1151965 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.1 BrCCOc1ccc(cc1)F Amb1152775 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.1 Br[Zn]CCc1ccc(cc1)Br Amb13890855 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|1,0,2]=4 465 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|1,0,2]=4 466 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|1,0,2]=4 467 B11R1.1 C#CCNC=1C=CC(=O)NC1 Amb25751082 [0,1,0,0,0,0|1,0,2]=4 468 B11R1.1 C#CCNc1ccc(Cl)c[n]1 Amb18284774 [0,1,0,0,0,0|1,0,2]=4 469 B11R1.1 C#CCNc1ccc(F)[n]c1 Amb25134288 [0,1,0,0,0,0|1,0,2]=4 470 B11R1.1 C#CCNc1ccc(F)c[n]1 Amb18958853 [0,1,0,0,0,0|1,0,2]=4 471 B11R1.1 C#CCNc1ccc(F)cc1 Amb24070273 [0,1,0,0,0,0|0,0,2]=3 472 B11R1.1 C#CCNc1ccc(I)cc1 Amb25195277 [0,1,0,0,0,0|0,0,2]=3 473 B11R1.1 C#CCNc1ccc(N)c[n]1 Amb25834920 [0,1,0,0,0,0|1,0,2]=4 474 B11R1.1 C#CCNc1ccc(O)cc1 Amb24563278 [0,1,0,0,0,0|0,0,2]=3 475 B11R1.1 C#CCOc1ccc(F)cc1 Amb18182727 [0,1,0,0,0,0|1,0,2]=4 476 B11R1.1 C#CCOc1ccc(I)cc1 Amb24476574 [0,1,0,0,0,0|1,0,2]=4 477 B11R1.1 C#CCOc1ccc(N)cc1 Amb22587338 [0,1,0,0,0,0|1,0,2]=4 478 B11R1.1 C#CCOc1ccc(cc1)N Amb13783679 [0,1,0,0,0,0|1,0,2]=4 479 B11R1.1 C#CCSc1ccc(Br)cc1 Amb24669370 [0,1,0,0,0,0|1,0,2]=4 480 B11R1.1 C#CCSc1ccc(F)cc1 Amb18801035 [0,1,0,0,0,0|1,0,2]=4 481 B11R1.1 C#CCSc1ccc(O)cc1 Amb18792578 [0,1,0,0,0,0|1,0,2]=4 482 B11R1.1 C=CCCc1ccc(Br)c[n]1 Amb24759377 [0,1,0,0,0,0|2,0,0]=3 483 B11R1.1 C=CCCc1ccc(I)cc1 Amb25349986 [0,1,0,0,0,0|1,0,0]=2 484 B11R1.1 C=CCCc1ccc(N)cc1 Amb18124837 [0,1,0,0,0,0|1,0,0]=2 485 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|1,0,0]=2 486 B11R1.1 C=CCNc1[n]cc(Cl)c[n]1 Amb24701751 [0,1,0,0,0,0|2,0,0]=3 487 B11R1.1 C=CCNc1[n]cc(F)c[n]1 Amb24486785 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.1 C=CCNc1[n]cc(I)c[n]1 Amb24488136 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.1 C=CCNc1[n]cc(N)c[n]1 Amb18299105 [0,1,0,0,0,0|2,0,0]=3 490 B11R1.1 C=CCNc1c[n]c(Br)c[n]1 Amb25150521 [0,1,0,0,0,0|2,0,0]=3 491 B11R1.1 C=CCNc1c[n]c(N)c[n]1 Amb24744048 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.1 C=CCNc1ccc(Br)c[n]1 Amb18292083 [0,1,0,0,0,0|1,0,0]=2 493 B11R1.1 C=CCNc1ccc(Cl)[n][n]1 Amb18985920 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.1 C=CCNc1ccc(Cl)[n]c1 Amb25046921 [0,1,0,0,0,0|1,0,0]=2 495 B11R1.1 C=CCNc1ccc(Cl)c[n]1 Amb18986517 [0,1,0,0,0,0|1,0,0]=2 496 B11R1.1 C=CCNc1ccc(F)c[n]1 Amb18986520 [0,1,0,0,0,0|1,0,0]=2 497 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|0,0,0]=1 498 B11R1.1 C=CCNc1ccc(O)[n][n]1 Amb18125267 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.1 C=CCNc1ccc(cc1)Br Amb17306795 [0,1,0,0,0,0|0,0,0]=1 500 B11R1.1 C=CCNc1ccc(cc1)C Amb17306868 [0,1,0,0,0,0|0,0,0]=1 501 B11R1.1 C=CCNc1ccc(cc1)Cl Amb17307236 [0,1,0,0,0,0|0,0,0]=1 502 B11R1.1 C=CCNc1ccc(cc1)F Amb17306180 [0,1,0,0,0,0|0,0,0]=1 503 B11R1.1 C=CCNc1ccc(cc1)I Amb17306247 [0,1,0,0,0,0|0,0,0]=1 504 B11R1.1 C=CCNc1ccc(cn1)N Amb17042248 [0,1,0,0,0,0|1,0,0]=2 505 B11R1.1 C=CCNc1ccc(nc1)N Amb17041329 [0,1,0,0,0,0|1,0,0]=2 506 B11R1.1 C=CCOC=1C=CC(=O)NN1 Amb25178565 [0,1,0,0,0,0|3,0,0]=4 507 B11R1.1 C=CCOc1[n]cc(Br)c[n]1 Amb25145794 [0,1,0,0,0,0|3,0,0]=4 508 B11R1.1 C=CCOc1[n]cc(Cl)c[n]1 Amb24756911 [0,1,0,0,0,0|3,0,0]=4 509 B11R1.1 C=CCOc1c[n]c(N)c[n]1 Amb25312198 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.1 C=CCOc1ccc(Br)[n]c1 Amb24434702 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.1 C=CCOc1ccc(Br)c[n]1 Amb25828007 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|1,0,0]=2 513 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|1,0,0]=2 514 B11R1.1 C=CCOc1ccc(N)[n][n]1 Amb25708198 [0,1,0,0,0,0|3,0,0]=4 515 B11R1.1 C=CCOc1ccc(N)c[n]1 Amb24062310 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.1 C=CCSc1[n]cc(Br)c[n]1 Amb25100418 [0,1,0,0,0,0|3,0,0]=4 517 B11R1.1 C=CCSc1[n]cc(Cl)c[n]1 Amb24623077 [0,1,0,0,0,0|3,0,0]=4 518 B11R1.1 C=CCSc1[n]cc(N)c[n]1 Amb25152057 [0,1,0,0,0,0|3,0,0]=4 519 B11R1.1 C=CCSc1[n]cc(O)c[n]1 Amb18126529 [0,1,0,0,0,0|3,0,0]=4 520 B11R1.1 C=CCSc1ccc(Br)c[n]1 Amb24367725 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.1 C=CCSc1ccc(Cl)[n][n]1 Amb25152058 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|1,0,0]=2 523 B11R1.1 C=C\C=C/c1ccc(O)cc1 Amb24103177 [0,1,0,0,0,0|1,0,1]=3 524 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [0,1,0,0,0,0|1,0,1]=3 525 B11R1.1 C=C\C=C\c1ccc(N)[n]c1 Amb24567231 [0,1,0,0,0,0|2,0,1]=4 526 B11R1.1 C=C\C=C\c1ccc(N)cc1 Amb24673532 [0,1,0,0,0,0|1,0,1]=3 527 B11R1.1 C=C\C=C\c1ccc(O)cc1 Amb25227603 [0,1,0,0,0,0|1,0,1]=3 528 B11R1.1 C=NCCc1ccc(O)cc1 Amb25327788 [0,1,0,0,0,0|2,0,0]=3 529 B11R1.1 C=N\N=C\c1ccc(F)cc1 Amb25260127 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.1 CC=CCc1ccc(O)cc1 Amb24094301 [0,1,0,0,0,0|1,0,2]=4 531 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|1,0,2]=4 532 B11R1.1 CCCNc1c[n]c(Cl)cc1 Amb24700682 [0,1,0,0,0,0|1,0,2]=4 533 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [0,1,0,0,0,0|0,0,2]=3 534 B11R1.1 CCCNc1ccc(F)c[n]1 Amb18975389 [0,1,0,0,0,0|1,0,2]=4 535 B11R1.1 CCCNc1ccc(cn1)N Amb1113758 [0,1,0,0,0,0|1,0,2]=4 536 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [0,1,0,0,0,0|1,0,2]=4 537 B11R1.1 CCCOc1ccc(F)cc1 Amb24105714 [0,1,0,0,0,0|1,0,2]=4 538 B11R1.1 CCCOc1ccc(I)cc1 Amb24064716 [0,1,0,0,0,0|1,0,2]=4 539 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [0,1,0,0,0,0|1,0,2]=4 540 B11R1.1 CCCOc1ccc(cc1)N Amb1125044 [0,1,0,0,0,0|1,0,2]=4 541 B11R1.1 CCCOc1ccc(cc1)O Amb1810008 [0,1,0,0,0,0|1,0,2]=4 542 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [0,1,0,0,0,0|1,0,2]=4 543 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [0,1,0,0,0,0|1,0,2]=4 544 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [0,1,0,0,0,0|1,0,2]=4 545 B11R1.1 CCNNc1ccc(F)cc1 Amb24086321 [0,1,0,0,0,0|1,0,2]=4 546 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.1 COCNc1ccc(F)cc1 Amb24070274 [0,1,0,0,0,0|1,0,1]=3 552 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.1 COCOc1ccc(N)cc1 Amb24092674 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [0,1,0,0,0,0|2,0,1]=4 556 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [0,1,0,0,0,0|2,0,1]=4 557 B11R1.1 COCSc1ccc(Cl)cc1 Amb24393521 [0,1,0,0,0,0|2,0,1]=4 558 B11R1.1 COCSc1ccc(N)cc1 Amb25714979 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|2,0,1]=4 560 B11R1.1 CSCOc1ccc(Cl)cc1 Amb24553356 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.1 CSCOc1ccc(F)cc1 Amb24645973 [0,1,0,0,0,0|2,0,1]=4 562 B11R1.1 CSCSc1ccc(Br)cc1 Amb25162619 [0,1,0,0,0,0|2,0,1]=4 563 B11R1.1 CSCSc1ccc(F)cc1 Amb25768258 [0,1,0,0,0,0|2,0,1]=4 564 B11R1.1 C\C=C/Oc1ccc(N)cc1 Amb24103180 [0,1,0,0,0,0|1,0,2]=4 565 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,0,0,0,0|1,0,2]=4 566 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,0,0,0,0|1,0,2]=4 567 B11R1.1 C\C=C\Nc1ccc(F)cc1 Amb24070275 [0,1,0,0,0,0|0,0,2]=3 568 B11R1.1 C\N=C\Nc1ccc(Cl)cc1 Amb25294306 [0,1,0,0,0,0|1,0,2]=4 569 B11R1.1 C\N=N\Nc1ccc(Br)cc1 Amb25312604 [0,1,0,0,0,0|2,0,1]=4 570 B11R1.1 Cc1ccc(CCC#C)cc1 Amb18634818 [0,1,0,0,0,0|1,0,2]=4 571 B11R1.1 Cc1ccc(CCC=C)[n]c1 Amb24100505 [0,1,0,0,0,0|2,0,0]=3 572 B11R1.1 Cc1ccc(CCC=O)[n]c1 Amb25723084 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [0,1,0,0,0,0|1,0,2]=4 574 B11R1.1 Cc1ccc(C\C=C\Br)cc1 Amb25720563 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.1 Cc1ccc(NCC#C)[n]c1 Amb18958811 [0,1,0,0,0,0|1,0,2]=4 576 B11R1.1 Cc1ccc(NCC=C)[n][n]1 Amb18295555 [0,1,0,0,0,0|2,0,0]=3 577 B11R1.1 Cc1ccc(NCC=C)[n]c1 Amb18986518 [0,1,0,0,0,0|1,0,0]=2 578 B11R1.1 Cc1ccc(NCCCl)[n]c1 Amb25341757 [0,1,0,0,0,0|2,0,1]=4 579 B11R1.1 Cc1ccc(NCCN)[n]c1 Amb19515509 [0,1,0,0,0,0|2,0,1]=4 580 B11R1.1 Cc1ccc([n]c1)OCC=C Amb24631767 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.1 Cc1ccc(c[n]1)C#CC=C Amb24070741 [0,1,0,0,0,0|2,0,1]=4 582 B11R1.1 Cc1ccc(c[n]1)NCC#C Amb25705832 [0,1,0,0,0,0|1,0,2]=4 583 B11R1.1 Cc1ccc(c[n]1)NCCN Amb24477635 [0,1,0,0,0,0|2,0,1]=4 584 B11R1.1 Cc1ccc(c[n]1)OCC=C Amb25838352 [0,1,0,0,0,0|2,0,0]=3 585 B11R1.1 Cc1ccc(cc1)C#CC=O Amb18117785 [0,1,0,0,0,0|2,0,1]=4 586 B11R1.1 Cc1ccc(cc1)NCC#C Amb21953776 [0,1,0,0,0,0|0,0,2]=3 587 B11R1.1 Cc1ccc(cc1)NCCBr Amb24575185 [0,1,0,0,0,0|1,0,1]=3 588 B11R1.1 Cc1ccc(cc1)NCCS Amb24538179 [0,1,0,0,0,0|1,0,1]=3 589 B11R1.1 Cc1ccc(cc1)NCOC Amb25301269 [0,1,0,0,0,0|1,0,1]=3 590 B11R1.1 Cc1ccc(cc1)NN=NC Amb22227984 [0,1,0,0,0,0|2,0,1]=4 591 B11R1.1 Cc1ccc(cc1)OCC#C Amb19373357 [0,1,0,0,0,0|1,0,2]=4 592 B11R1.1 Cc1ccc(cc1)OCOC Amb20241783 [0,1,0,0,0,0|2,0,1]=4 593 B11R1.1 Cc1ccc(cc1)SCOC Amb25032720 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.1 Cc1ccc(cc1)S\C=C\Cl Amb24603050 [0,1,0,0,0,0|2,0,1]=4 595 B11R1.1 Cc1ccc(cc1)\N=C\C=O Amb24484947 [0,1,0,0,0,0|1,0,2]=4 596 B11R1.1 ClCCCc1ccc(cc1)Br Amb17104549 [0,1,0,0,0,0|2,0,1]=4 597 B11R1.1 ClCCCc1ccc(cc1)C Amb17104527 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.1 ClCCCc1ccc(cc1)F Amb17104529 [0,1,0,0,0,0|2,0,1]=4 599 B11R1.1 ClCCCc1ccc(cc1)N Amb17477708 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.1 ClCCCc1ccc(cc1)O Amb17477722 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.1 ClCCNc1ccc(cc1)Br Amb17346195 [0,1,0,0,0,0|1,0,1]=3 602 B11R1.1 ClCCNc1ccc(cc1)C Amb17334787 [0,1,0,0,0,0|1,0,1]=3 603 B11R1.1 ClCCNc1ccc(cc1)Cl Amb17336182 [0,1,0,0,0,0|1,0,1]=3 604 B11R1.1 ClCCNc1ccc(cc1)F Amb17334965 [0,1,0,0,0,0|1,0,1]=3 605 B11R1.1 ClCCSc1ccc(cc1)C Amb1657286 [0,1,0,0,0,0|2,0,1]=4 606 B11R1.1 ClCCSc1ccc(cc1)Cl Amb1154201 [0,1,0,0,0,0|2,0,1]=4 607 B11R1.1 Clc1ccc(CC[Mg]Cl)cc1 Amb22897275 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.1 Clc1ccc(CC[Zn]Br)cc1 Amb22000488 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.1 Clc1ccc(CC[Zn]Cl)cc1 Amb22897728 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.1 Clc1ccc(NCCCl)[n]c1 Amb25191177 [0,1,0,0,0,0|2,0,1]=4 611 B11R1.1 Clc1ccc(cc1)OCCI Amb25833023 [0,1,0,0,0,0|2,0,1]=4 612 B11R1.1 Clc1ccc(cc1)O\C=C/Cl Amb24533093 [0,1,0,0,0,0|2,0,1]=4 613 B11R1.1 FCCOc1ccc(Br)cc1 Amb22227902 [0,1,0,0,0,0|2,0,1]=4 614 B11R1.1 FCCOc1ccc(I)cc1 Amb22227565 [0,1,0,0,0,0|2,0,1]=4 615 B11R1.1 FCCOc1ccc(S)cc1 Amb23580141 [0,1,0,0,0,0|2,0,1]=4 616 B11R1.1 FCCSc1ccc(Cl)cc1 Amb24644973 [0,1,0,0,0,0|2,0,1]=4 617 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.1 Fc1ccc(CNC=S)cc1 Amb25241123 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.1 Fc1ccc(NCCF)[n]c1 Amb25831303 [0,1,0,0,0,0|2,0,1]=4 620 B11R1.1 Fc1ccc(cc1)NCCS Amb24545874 [0,1,0,0,0,0|1,0,1]=3 621 B11R1.1 Fc1ccc(cc1)OCCF Amb24686958 [0,1,0,0,0,0|2,0,1]=4 622 B11R1.1 Fc1ccc(cc1)SCCF Amb24484072 [0,1,0,0,0,0|2,0,1]=4 623 B11R1.1 Fc1ccc(cc1)SCCS Amb24689240 [0,1,0,0,0,0|2,0,1]=4 624 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|2,0,1]=4 625 B11R1.1 N#CCCc1ccc(cc1)C Amb17204297 [0,1,0,0,0,0|2,0,1]=4 626 B11R1.1 N#CCCc1ccc(cc1)F Amb17204299 [0,1,0,0,0,0|2,0,1]=4 627 B11R1.1 N#CCSc1ccc(O)cc1 Amb18180090 [0,1,0,0,0,0|2,0,1]=4 628 B11R1.1 N#CCSc1ccc(cc1)Br Amb17644 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.1 N#CCSc1ccc(cc1)Cl Amb1156063 [0,1,0,0,0,0|2,0,1]=4 630 B11R1.1 N#CCSc1ccc(cc1)F Amb1152494 [0,1,0,0,0,0|2,0,1]=4 631 B11R1.1 NCCCc1ccc(I)cc1 Amb25172834 [0,1,0,0,0,0|2,0,1]=4 632 B11R1.1 NCCCc1ccc(S)cc1 Amb25228495 [0,1,0,0,0,0|2,0,1]=4 633 B11R1.1 NCCCc1ccc(cc1)Cl Amb1092541 [0,1,0,0,0,0|2,0,1]=4 634 B11R1.1 NCCCc1ccc(cc1)Cl Amb13952055 [0,1,0,0,0,0|2,0,1]=4 635 B11R1.1 NCCCc1ccc(cc1)N Amb17477693 [0,1,0,0,0,0|2,0,1]=4 636 B11R1.1 NCCCc1ccc(cc1)O Amb10066893 [0,1,0,0,0,0|2,0,1]=4 637 B11R1.1 NCCCc1ccc(cc1)O Amb17598403 [0,1,0,0,0,0|2,0,1]=4 638 B11R1.1 NCCNc1ccc(F)c[n]1 Amb18291560 [0,1,0,0,0,0|2,0,1]=4 639 B11R1.1 NCCNc1ccc(F)cc1 Amb17845075 [0,1,0,0,0,0|1,0,1]=3 640 B11R1.1 NCCNc1ccc(cc1)Br Amb17057752 [0,1,0,0,0,0|1,0,1]=3 641 B11R1.1 NCCNc1ccc(cc1)C Amb17057746 [0,1,0,0,0,0|1,0,1]=3 642 B11R1.1 NCCNc1ccc(cc1)Cl Amb17057751 [0,1,0,0,0,0|1,0,1]=3 643 B11R1.1 NCCOc1ccc(Br)cc1 Amb19338687 [0,1,0,0,0,0|2,0,1]=4 644 B11R1.1 NCCOc1ccc(O)cc1 Amb18125536 [0,1,0,0,0,0|2,0,1]=4 645 B11R1.1 NCCOc1ccc(cc1)Br Amb1098668 [0,1,0,0,0,0|2,0,1]=4 646 B11R1.1 NCCOc1ccc(cc1)C Amb1101721 [0,1,0,0,0,0|2,0,1]=4 647 B11R1.1 NCCOc1ccc(cc1)C Amb2196480 [0,1,0,0,0,0|2,0,1]=4 648 B11R1.1 NCCOc1ccc(cc1)Cl Amb1153919 [0,1,0,0,0,0|2,0,1]=4 649 B11R1.1 NCCOc1ccc(cc1)F Amb1102015 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.1 NCCSc1ccc(O)cc1 Amb18971693 [0,1,0,0,0,0|2,0,1]=4 651 B11R1.1 NCCSc1ccc(cc1)Br Amb1105170 [0,1,0,0,0,0|2,0,1]=4 652 B11R1.1 NCCSc1ccc(cc1)Cl Amb2236679 [0,1,0,0,0,0|2,0,1]=4 653 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|3,0,0]=4 654 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|3,0,0]=4 655 B11R1.1 Nc1c[n]c(cc1)NNC=O Amb18125379 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.1 Nc1ccc(CCCBr)cc1 Amb22229466 [0,1,0,0,0,0|2,0,1]=4 657 B11R1.1 Nc1ccc(CCCF)cc1 Amb25697152 [0,1,0,0,0,0|2,0,1]=4 658 B11R1.1 Nc1ccc(CCCO)cc1 Amb21964655 [0,1,0,0,0,0|2,0,1]=4 659 B11R1.1 Nc1ccc(CNC=O)cc1 Amb24072314 [0,1,0,0,0,0|3,0,0]=4 660 B11R1.1 Nc1ccc(NCCF)[n]c1 Amb24725236 [0,1,0,0,0,0|2,0,1]=4 661 B11R1.1 Nc1ccc(NCCO)[n]c1 Amb24080718 [0,1,0,0,0,0|2,0,1]=4 662 B11R1.1 Nc1ccc(c[n]1)NCCF Amb25150683 [0,1,0,0,0,0|2,0,1]=4 663 B11R1.1 Nc1ccc(c[n]1)NCCN Amb18991503 [0,1,0,0,0,0|2,0,1]=4 664 B11R1.1 Nc1ccc(cc1)NCC#N Amb24089891 [0,1,0,0,0,0|1,0,1]=3 665 B11R1.1 Nc1ccc(cc1)NCCF Amb25804656 [0,1,0,0,0,0|1,0,1]=3 666 B11R1.1 Nc1ccc(cc1)NCCN Amb18298668 [0,1,0,0,0,0|1,0,1]=3 667 B11R1.1 Nc1ccc(cc1)N\N=C\N Amb24637265 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.1 Nc1ccc(cc1)OCCBr Amb20620461 [0,1,0,0,0,0|2,0,1]=4 669 B11R1.1 Nc1ccc(cc1)OCCCl Amb18126855 [0,1,0,0,0,0|2,0,1]=4 670 B11R1.1 Nc1ccc(cc1)OCCF Amb23579951 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.1 Nc1ccc(cc1)OCCN Amb23401881 [0,1,0,0,0,0|2,0,1]=4 672 B11R1.1 Nc1ccc(cc1)SCCN Amb18975711 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.1 O=C1C=CC(C=C1)=NNC=O Amb25730106 [0,1,0,0,0,0|2,0,1]=4 674 B11R1.1 O=CC#Cc1ccc(Br)cc1 Amb18115173 [0,1,0,0,0,0|2,0,1]=4 675 B11R1.1 O=CC#Cc1ccc(Cl)cc1 Amb18117815 [0,1,0,0,0,0|2,0,1]=4 676 B11R1.1 O=CC#Cc1ccc(F)cc1 Amb18117287 [0,1,0,0,0,0|2,0,1]=4 677 B11R1.1 O=CC=Cc1ccc(cc1)Br Amb17609956 [0,1,0,0,0,0|2,0,1]=4 678 B11R1.1 O=CCCN1C=CC(=O)C=C1 Amb18177172 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.1 O=CCCc1ccc(Br)c[n]1 Amb24704728 [0,1,0,0,0,0|3,0,0]=4 680 B11R1.1 O=CCCc1ccc(cc1)Br Amb10602155 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.1 O=CCCc1ccc(cc1)F Amb10602156 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.1 O=CCCc1ccc(cc1)O Amb17081693 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.1 O=CCNc1ccc(Br)c[n]1 Amb24484897 [0,1,0,0,0,0|2,0,0]=3 684 B11R1.1 O=CCOc1ccc(cc1)Br Amb17099949 [0,1,0,0,0,0|2,0,0]=3 685 B11R1.1 O=CCSc1ccc(Br)c[n]1 Amb25376662 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.1 O=CCSc1ccc(Cl)c[n]1 Amb24523121 [0,1,0,0,0,0|3,0,0]=4 687 B11R1.1 O=CCSc1ccc(cc1)Br Amb17082907 [0,1,0,0,0,0|2,0,0]=3 688 B11R1.1 O=CCSc1ccc(cc1)C Amb17082904 [0,1,0,0,0,0|2,0,0]=3 689 B11R1.1 O=CCSc1ccc(cc1)Cl Amb17082906 [0,1,0,0,0,0|2,0,0]=3 690 B11R1.1 O=CCSc1ccc(cc1)F Amb17082905 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,0,0,0,0|3,0,0]=4 692 B11R1.1 O=CNCc1ccc(cc1)C Amb1916037 [0,1,0,0,0,0|3,0,0]=4 693 B11R1.1 O=CNNc1ccc(Br)c[n]1 Amb24596860 [0,1,0,0,0,0|3,0,0]=4 694 B11R1.1 O=CNNc1ccc(Br)cc1 Amb25147924 [0,1,0,0,0,0|2,0,0]=3 695 B11R1.1 O=C\C=C/c1ccc(Cl)cc1 Amb24484764 [0,1,0,0,0,0|2,0,1]=4 696 B11R1.1 O=C\C=C\c1ccc(I)cc1 Amb24523100 [0,1,0,0,0,0|2,0,1]=4 697 B11R1.1 O=C\C=C\c1ccc(cc1)Br Amb1787168 [0,1,0,0,0,0|2,0,1]=4 698 B11R1.1 O=C\C=C\c1ccc(cc1)C Amb17232009 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.1 OCCCc1ccc(cc1)Br Amb13883587 [0,1,0,0,0,0|2,0,1]=4 701 B11R1.1 OCCCc1ccc(cc1)F Amb17089497 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.1 OCCCc1ccc(cc1)N Amb17477700 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.1 OCCNc1ccc(F)c[n]1 Amb18975393 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.1 OCCNc1ccc(I)c[n]1 Amb25301350 [0,1,0,0,0,0|2,0,1]=4 705 B11R1.1 OCCOc1ccc(S)cc1 Amb24100726 [0,1,0,0,0,0|2,0,1]=4 706 B11R1.1 OCCOc1ccc(cc1)C Amb2209347 [0,1,0,0,0,0|2,0,1]=4 707 B11R1.1 OCCOc1ccc(cc1)Cl Amb2209356 [0,1,0,0,0,0|2,0,1]=4 708 B11R1.1 OCCOc1ccc(cc1)N Amb15740917 [0,1,0,0,0,0|2,0,1]=4 709 B11R1.1 OCCSc1ccc(cc1)O Amb10575943 [0,1,0,0,0,0|2,0,1]=4 710 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|2,0,1]=4 711 B11R1.1 Oc1ccc(CNC=O)cc1 Amb25172814 [0,1,0,0,0,0|3,0,0]=4 712 B11R1.1 Oc1ccc(C\C=C\Cl)cc1 Amb25724911 [0,1,0,0,0,0|2,0,1]=4 713 B11R1.1 Oc1ccc(NCCO)[n]c1 Amb24458585 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.1 Oc1ccc(cc1)C#CC=O Amb18117760 [0,1,0,0,0,0|2,0,1]=4 715 B11R1.1 Oc1ccc(cc1)OCC=O Amb18125345 [0,1,0,0,0,0|2,0,0]=3 716 B11R1.1 Oc1ccc(cc1)OCCCl Amb18126982 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.1 Oc1ccc(cc1)OCCF Amb24543531 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.1 Oc1ccc(cc1)SCCCl Amb18650050 [0,1,0,0,0,0|2,0,1]=4 719 B11R1.1 Oc1ccc(cc1)SCCF Amb25699332 [0,1,0,0,0,0|2,0,1]=4 720 B11R1.1 SCCCc1ccc(cc1)Br Amb17407562 [0,1,0,0,0,0|2,0,1]=4 721 B11R1.1 SCCCc1ccc(cc1)C Amb17400220 [0,1,0,0,0,0|2,0,1]=4 722 B11R1.1 SCCCc1ccc(cc1)Cl Amb17401097 [0,1,0,0,0,0|2,0,1]=4 723 B11R1.1 SCCCc1ccc(cc1)F Amb17400333 [0,1,0,0,0,0|2,0,1]=4 724 B11R1.1 SCCNc1ccc(Cl)cc1 Amb25696044 [0,1,0,0,0,0|1,0,1]=3 725 B11R1.1 SCCOc1ccc(cc1)F Amb17232868 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.1 SCCOc1ccc(cc1)N Amb17504126 [0,1,0,0,0,0|2,0,1]=4 727 B11R1.1 SCCSc1ccc(cc1)C Amb13881735 [0,1,0,0,0,0|2,0,1]=4 728 B11R1.1 SCCSc1ccc(cc1)Cl Amb13881736 [0,1,0,0,0,0|2,0,1]=4 729 B11R1.1 [C-]#[N+]CCc1ccc(O)cc1 Amb25730088 [0,1,0,0,0,0|2,0,1]=4 730 B11R1.1 [C-]#[N+]CSc1ccc(C)cc1 Amb25777926 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.1 [NH3+]c1ccc(cc1)OCCF Amb22455028 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,1,0,0,0,0|1,0,2]=4 734 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|1,0,2]=4 735 B11R1.16 C#CCS(=O)c1ccccc1 Amb25241742 [0,1,0,0,0,0|1,0,2]=4 736 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,1,0,0,0,0|1,0,2]=4 737 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,1,0,0,0,0|1,0,2]=4 738 B11R1.16 C=C=CC(=O)c1ccccc1 Amb25053112 [0,1,0,0,0,0|1,0,2]=4 739 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [0,1,0,0,0,0|1,0,2]=4 740 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [0,1,0,0,0,0|1,0,2]=4 741 B11R1.16 C=CCC(=O)c1[n]ccc[n]1 Amb24533192 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.16 C=CCC(=O)c1c[n]c[n]c1 Amb24660158 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.16 C=CCC(=O)c1c[n]cc[n]1 Amb25730291 [0,1,0,0,0,0|3,0,0]=4 744 B11R1.16 C=CCC(=O)c1cc[n][n]c1 Amb24623360 [0,1,0,0,0,0|3,0,0]=4 745 B11R1.16 C=CCC(=O)c1cc[n]c[n]1 Amb25075492 [0,1,0,0,0,0|3,0,0]=4 746 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|1,0,0]=2 747 B11R1.16 C=CCC(=O)c1ccccn1 Amb17334265 [0,1,0,0,0,0|2,0,0]=3 748 B11R1.16 C=CCC(=O)c1cccnc1 Amb17334267 [0,1,0,0,0,0|2,0,0]=3 749 B11R1.16 C=CCC(=O)c1ccncc1 Amb17334269 [0,1,0,0,0,0|2,0,0]=3 750 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,1,0,0,0,0|1,0,0]=2 751 B11R1.16 C=CCC(N)c1[n]ccc[n]1 Amb18977465 [0,1,0,0,0,0|3,0,0]=4 752 B11R1.16 C=CCC(N)c1c[n]cc[n]1 Amb18292011 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.16 C=CCC(N)c1c[n]ccc1 Amb18292092 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.16 C=CCC(N)c1cc[n]c[n]1 Amb24504901 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb18292093 [0,1,0,0,0,0|2,0,0]=3 756 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb19374106 [0,1,0,0,0,0|2,0,0]=3 757 B11R1.16 C=CCC(N)c1cccc[n]1 Amb18977590 [0,1,0,0,0,0|2,0,0]=3 758 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,1,0,0,0,0|1,0,0]=2 759 B11R1.16 C=CCC(O)c1[n]ccc[n]1 Amb18177144 [0,1,0,0,0,0|3,0,0]=4 760 B11R1.16 C=CCC(O)c1c[n]cc[n]1 Amb18177151 [0,1,0,0,0,0|3,0,0]=4 761 B11R1.16 C=CCC(O)c1cccc[n]1 Amb25735233 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,1,0,0,0,0|1,0,0]=2 763 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,1,0,0,0,0|1,0,0]=2 764 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,1,0,0,0,0|1,0,0]=2 765 B11R1.16 C=CCN(O)c1cccc[n]1 Amb25174254 [0,1,0,0,0,0|1,0,0]=2 766 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [0,1,0,0,0,0|0,0,0]=1 767 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|1,0,0]=2 768 B11R1.16 C=CC[C@@H](N)c1c[n]cc[n]1 Amb24504922 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.16 C=CC[C@@H](N)c1c[n]ccc1 Amb24487504 [0,1,0,0,0,0|2,0,0]=3 770 B11R1.16 C=CC[C@@H](N)c1cccc[n]1 Amb25844369 [0,1,0,0,0,0|2,0,0]=3 771 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|1,0,0]=2 772 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|1,0,0]=2 773 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|1,0,0]=2 774 B11R1.16 C=CC[C@H](N)c1c[n]c[n]c1 Amb25324319 [0,1,0,0,0,0|3,0,0]=4 775 B11R1.16 C=CC[C@H](N)c1c[n]ccc1 Amb24699940 [0,1,0,0,0,0|2,0,0]=3 776 B11R1.16 C=CC[C@H](N)c1cccc[n]1 Amb25117558 [0,1,0,0,0,0|2,0,0]=3 777 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [0,1,0,0,0,0|2,0,0]=3 778 B11R1.16 C=CC[C@H](O)c1cc[n]cc1 Amb25854958 [0,1,0,0,0,0|2,0,0]=3 779 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,1,0,0,0,0|1,0,0]=2 780 B11R1.16 C=CNC(=O)c1ccc[n]c1 Amb24715715 [0,1,0,0,0,0|3,0,0]=4 781 B11R1.16 C=CNC(=O)c1ccccc1 Amb24096819 [0,1,0,0,0,0|2,0,0]=3 782 B11R1.16 C=COC(=O)c1cc[n]cc1 Amb24099554 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.16 C=COC(=O)c1ccc[n]c1 Amb24062392 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.16 C=COC(=O)c1cccc[n]1 Amb24061334 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,1,0,0,0,0|2,0,0]=3 786 B11R1.16 C=C\C=C(\N)/c1cccc[n]1 Amb24579514 [0,1,0,0,0,0|2,0,1]=4 787 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|1,0,2]=4 788 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [0,1,0,0,0,0|2,0,0]=3 789 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,1,0,0,0,0|1,0,0]=2 790 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.16 CC(CC=O)c1cc[n]cc1 Amb25283017 [0,1,0,0,0,0|3,0,0]=4 792 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|2,0,1]=4 793 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,1,0,0,0,0|3,0,0]=4 795 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [0,1,0,0,0,0|3,0,0]=4 796 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|2,0,0]=3 797 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|3,0,0]=4 798 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [0,1,0,0,0,0|2,0,1]=4 799 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,1,0,0,0,0|1,0,2]=4 801 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [0,1,0,0,0,0|1,0,2]=4 802 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,1,0,0,0,0|1,0,2]=4 803 B11R1.16 CCCN(C)c1cccc[n]1 Amb24719444 [0,1,0,0,0,0|1,0,2]=4 804 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [0,1,0,0,0,0|0,0,2]=3 805 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|1,0,2]=4 806 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,1,0,0,0,0|1,0,2]=4 807 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|1,0,2]=4 808 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|1,0,2]=4 809 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|1,0,2]=4 810 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,1,0,0,0,0|1,0,2]=4 811 B11R1.16 CN(CC#C)c1cccc[n]1 Amb25152733 [0,1,0,0,0,0|1,0,2]=4 812 B11R1.16 CN(CC#C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|0,0,2]=3 813 B11R1.16 CN(CC#N)c1cccc[n]1 Amb24397681 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.16 CN(CC=C)c1[n]ccc[n]1 Amb24378968 [0,1,0,0,0,0|2,0,0]=3 815 B11R1.16 CN(CC=C)c1ccc[n][n]1 Amb25130186 [0,1,0,0,0,0|2,0,0]=3 816 B11R1.16 CN(CC=C)c1cccc[n]1 Amb25072101 [0,1,0,0,0,0|1,0,0]=2 817 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|1,0,1]=3 818 B11R1.16 CN(CCCl)c1cccc[n]1 Amb24695070 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,1,0,0,0,0|1,0,1]=3 820 B11R1.16 CN(CCN)c1cc[n]cc1 Amb18993102 [0,1,0,0,0,0|2,0,1]=4 821 B11R1.16 CN(CCN)c1cccc[n]1 Amb18302344 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.16 CN(CCO)c1cc[n]cc1 Amb18179433 [0,1,0,0,0,0|2,0,1]=4 823 B11R1.16 CN(CCO)c1cc[n]cc1 Amb19373596 [0,1,0,0,0,0|2,0,1]=4 824 B11R1.16 CN(CCO)c1cccc[n]1 Amb21955495 [0,1,0,0,0,0|2,0,1]=4 825 B11R1.16 CN(N=C=O)c1ccccc1 Amb25242708 [0,1,0,0,0,0|2,0,1]=4 826 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [0,1,0,0,0,0|2,0,0]=3 827 B11R1.16 CN(\N=C\N)c1ccccc1 Amb25840394 [0,1,0,0,0,0|2,0,0]=3 828 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [0,1,0,0,0,0|2,0,1]=4 829 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,1,0,0,0,0|2,0,1]=4 830 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|2,0,1]=4 831 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|2,0,1]=4 832 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,1,0,0,0,0|2,0,1]=4 833 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,1,0,0,0,0|2,0,1]=4 835 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,1,0,0,0,0|2,0,1]=4 836 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,1,0,0,0,0|2,0,1]=4 837 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,1,0,0,0,0|2,0,1]=4 838 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,1,0,0,0,0|2,0,1]=4 844 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,1,0,0,0,0|2,0,1]=4 846 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|2,0,1]=4 847 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,1,0,0,0,0|1,1,1]=4 849 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,1,0,0,0,0|2,0,1]=4 854 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,1,0,0,0,0|2,0,0]=3 855 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.16 C\C(=C\C=O)\c1ccccc1 Amb25124926 [0,1,0,0,0,0|2,0,1]=4 859 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,0|1,0,2]=4 860 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,1,0,0,0,0|1,0,2]=4 861 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,1,0,0,0,0|1,0,2]=4 862 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,1,0,0,0,0|1,0,2]=4 863 B11R1.16 C\C=N/C(=O)c1ccccc1 Amb24072877 [0,1,0,0,0,0|2,0,1]=4 864 B11R1.16 C\C=N\C(=O)c1ccccc1 Amb24563950 [0,1,0,0,0,0|2,0,1]=4 865 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,1]=4 866 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,1]=4 867 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,1,0,0,0,0|2,0,1]=4 869 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,1,0,0,0,0|1,0,1]=3 870 B11R1.16 ClCCP(Cl)c1ccccc1 Amb24398805 [0,1,0,0,0,0|1,1,1]=4 871 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,1,0,0,0,0|2,0,1]=4 872 B11R1.16 Cl\C=C\C(=O)c1ccccc1 Amb17594153 [0,1,0,0,0,0|2,0,1]=4 873 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [0,1,0,0,0,0|2,0,1]=4 874 B11R1.16 FCCC(=O)c1ccccc1 Amb10603695 [0,1,0,0,0,0|2,0,1]=4 875 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|2,0,1]=4 876 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,1,0,0,0,0|2,0,1]=4 878 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|2,0,1]=4 880 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|2,0,1]=4 881 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,1,0,0,0,0|2,0,0]=3 882 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|2,0,1]=4 883 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|2,0,1]=4 884 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,1,0,0,0,0|2,0,1]=4 886 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|2,0,1]=4 887 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|2,0,1]=4 888 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,1,0,0,0,0|2,0,1]=4 889 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,1,0,0,0,0|2,0,1]=4 890 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,1,0,0,0,0|1,0,1]=3 891 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,1,0,0,0,0|1,0,1]=3 892 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|2,0,1]=4 893 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|2,0,1]=4 894 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,1,0,0,0,0|2,0,1]=4 895 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|2,0,1]=4 896 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|2,0,1]=4 897 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,1,0,0,0,0|1,0,1]=3 898 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [0,1,0,0,0,0|3,0,0]=4 899 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,1,0,0,0,0|3,0,0]=4 900 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,1,0,0,0,0|3,0,0]=4 901 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,1,0,0,0,0|3,0,0]=4 902 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,1,0,0,0,0|3,0,0]=4 903 B11R1.16 NOCC(=O)c1ccccc1 Amb22729387 [0,1,0,0,0,0|3,0,0]=4 904 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,1,0,0,0,0|3,0,0]=4 905 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,1,0,0,0,0|3,0,0]=4 906 B11R1.16 NSCC(=O)c1ccccc1 Amb24564884 [0,1,0,0,0,0|3,0,0]=4 907 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|2,0,1]=4 908 B11R1.16 N\C(=C\C=O)\c1ccccc1 Amb24514799 [0,1,0,0,0,0|2,0,1]=4 909 B11R1.16 N\C=C/C(=O)c1ccccc1 Amb24706769 [0,1,0,0,0,0|2,0,1]=4 910 B11R1.16 N\C=C\C(=O)c1ccccc1 Amb25730024 [0,1,0,0,0,0|2,0,1]=4 911 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,1,0,0,0,0|3,0,0]=4 912 B11R1.16 O=C(NC=O)c1ccccc1 Amb24096618 [0,1,0,0,0,0|3,0,0]=4 913 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb22330589 [0,1,0,0,0,0|2,0,1]=4 914 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb24121236 [0,1,0,0,0,0|2,0,1]=4 915 B11R1.16 O=C(\C=C/Cl)c1ccccc1 Amb25723188 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,0,0,0,0|3,0,0]=4 917 B11R1.16 O=CC=C(c1ccccc1)Cl Amb17232626 [0,1,0,0,0,0|2,0,1]=4 918 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,1,0,0,0,0|2,0,0]=3 919 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,1,0,0,0,0|2,0,0]=3 920 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,1,0,0,0,0|2,0,0]=3 921 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,1,0,0,0,0|2,0,0]=3 922 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,1,0,0,0,0|3,0,0]=4 923 B11R1.16 O=C\C=C(/F)\c1ccccc1 Amb18125100 [0,1,0,0,0,0|2,0,1]=4 924 B11R1.16 O=C\C=C(/S)\c1ccccc1 Amb18646120 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.16 O=C\C=C(\Br)/c1ccccc1 Amb25084228 [0,1,0,0,0,0|2,0,1]=4 926 B11R1.16 O=C\C=C(\Cl)/c1ccccc1 Amb19884139 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.16 O=C\C=C(\c1ccccc1)/C Amb17593660 [0,1,0,0,0,0|2,0,1]=4 928 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,1,0,0,0,0|3,0,0]=4 929 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [0,1,0,0,0,0|3,0,0]=4 930 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,1,0,0,0,0|2,0,1]=4 932 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,1,0,0,0,0|2,0,1]=4 933 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,1,0,0,0,0|3,0,0]=4 934 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,1,0,0,0,0|2,0,1]=4 935 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|2,0,1]=4 936 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,1,0,0,0,0|2,0,1]=4 937 B11R1.16 OCCN(c1ccccn1)C Amb2445428 [0,1,0,0,0,0|2,0,1]=4 938 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,1,0,0,0,0|3,0,0]=4 939 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [0,1,0,0,0,0|3,0,0]=4 941 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,1,0,0,0,0|2,0,0]=3 942 B11R1.16 O\C=C\C(=S)c1ccccc1 Amb24645164 [0,1,0,0,0,0|2,0,1]=4 943 B11R1.16 SCCC(=O)c1ccccc1 Amb17400214 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,1,0,0,0,0|1,0,1]=3 945 B11R1.16 [O-]/C=C\C(=O)c1ccccc1 Amb17843402 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.16 [O-]\C=C/C(=O)c1ccccc1 Amb2385893 [0,1,0,0,0,0|2,0,1]=4 947 B11R1.16 [O-]\C=C\C(=O)c1ccccc1 Amb22360915 [0,1,0,0,0,0|2,0,1]=4 948 B11R1.17 BrCCCc1ccccc1C Amb17104552 [0,1,0,0,0,0|2,0,1]=4 949 B11R1.17 BrCCCc1ccccc1Cl Amb17104560 [0,1,0,0,0,0|2,0,1]=4 950 B11R1.17 BrCCCc1ccccc1F Amb17104555 [0,1,0,0,0,0|2,0,1]=4 951 B11R1.17 BrCCOc1ccccc1C Amb1105693 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.17 BrCCOc1ccccc1Cl Amb1150980 [0,1,0,0,0,0|2,0,1]=4 953 B11R1.17 BrCCOc1ccccc1F Amb1103643 [0,1,0,0,0,0|2,0,1]=4 954 B11R1.17 Br[Mg]CCc1ccccc1F Amb13890864 [0,1,0,0,0,0|3,0,0]=4 955 B11R1.17 Br[Zn]CCc1ccccc1F Amb13890853 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.17 Brc1ccccc1CCCI Amb25329656 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|1,0,2]=4 958 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|1,0,2]=4 959 B11R1.17 C#CCNc1[n]cccc1Br Amb25857859 [0,1,0,0,0,0|1,0,2]=4 960 B11R1.17 C#CCNc1[n]cccc1Cl Amb18959026 [0,1,0,0,0,0|1,0,2]=4 961 B11R1.17 C#CCNc1[n]cccc1F Amb18963755 [0,1,0,0,0,0|1,0,2]=4 962 B11R1.17 C#CCNc1cc[n]cc1Br Amb24751562 [0,1,0,0,0,0|1,0,2]=4 963 B11R1.17 C#CCNc1cc[n]cc1N Amb25691037 [0,1,0,0,0,0|1,0,2]=4 964 B11R1.17 C#CCNc1ccccc1Br Amb25790145 [0,1,0,0,0,0|0,0,2]=3 965 B11R1.17 C#CCNc1ccccc1Cl Amb18800988 [0,1,0,0,0,0|0,0,2]=3 966 B11R1.17 C#CCNc1ccccc1N Amb24060500 [0,1,0,0,0,0|0,0,2]=3 967 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,1,0,0,0,0|1,0,2]=4 968 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,1,0,0,0,0|1,0,2]=4 969 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,1,0,0,0,0|1,0,2]=4 970 B11R1.17 C#CCSc1ccccc1Cl Amb18325307 [0,1,0,0,0,0|1,0,2]=4 971 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,1,0,0,0,0|1,0,2]=4 972 B11R1.17 C#CCSc1ccccc1O Amb18788312 [0,1,0,0,0,0|1,0,2]=4 973 B11R1.17 C=CC#Cc1ccccc1F Amb25349463 [0,1,0,0,0,0|1,0,1]=3 974 B11R1.17 C=CCCN1C=CC=NC1=O Amb25368695 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.17 C=CCCN1N=CC=CC1=O Amb25099106 [0,1,0,0,0,0|3,0,0]=4 976 B11R1.17 C=CCCc1[n]c[n]cc1Br Amb24087654 [0,1,0,0,0,0|3,0,0]=4 977 B11R1.17 C=CCCc1c[n]ccc1O Amb24334707 [0,1,0,0,0,0|2,0,0]=3 978 B11R1.17 C=CCCc1cc[n]cc1Cl Amb24693753 [0,1,0,0,0,0|2,0,0]=3 979 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|1,0,0]=2 980 B11R1.17 C=CCCc1ccccc1O Amb18124913 [0,1,0,0,0,0|1,0,0]=2 981 B11R1.17 C=CCNc1[n]c[n]cc1I Amb24462632 [0,1,0,0,0,0|2,0,0]=3 982 B11R1.17 C=CCNc1[n]cc[n]c1Cl Amb23571461 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.17 C=CCNc1[n]cc[n]c1N Amb25731449 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.17 C=CCNc1[n]cccc1Br Amb18986218 [0,1,0,0,0,0|1,0,0]=2 985 B11R1.17 C=CCNc1[n]cccc1Cl Amb18986014 [0,1,0,0,0,0|1,0,0]=2 986 B11R1.17 C=CCNc1[n]cccc1F Amb18996050 [0,1,0,0,0,0|1,0,0]=2 987 B11R1.17 C=CCNc1ccc[n]c1N Amb25289566 [0,1,0,0,0,0|1,0,0]=2 988 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|0,0,0]=1 989 B11R1.17 C=CCNc1ccccc1Cl Amb18185559 [0,1,0,0,0,0|0,0,0]=1 990 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|0,0,0]=1 991 B11R1.17 C=CCNc1ccccc1N Amb18992164 [0,1,0,0,0,0|0,0,0]=1 992 B11R1.17 C=CCNc1ccncc1N Amb17094087 [0,1,0,0,0,0|1,0,0]=2 993 B11R1.17 C=CCNc1ncccc1N Amb17067314 [0,1,0,0,0,0|1,0,0]=2 994 B11R1.17 C=CCOC1=CC=CNC1=O Amb18034612 [0,1,0,0,0,0|2,0,0]=3 995 B11R1.17 C=CCON1C=CC=CC1=O Amb22364567 [0,1,0,0,0,0|2,0,0]=3 996 B11R1.17 C=CCOc1[n]cc[n]c1Cl Amb18183621 [0,1,0,0,0,0|3,0,0]=4 997 B11R1.17 C=CCOc1[n]cccc1Br Amb24476578 [0,1,0,0,0,0|2,0,0]=3 998 B11R1.17 C=CCOc1c[n]ccc1I Amb24759266 [0,1,0,0,0,0|2,0,0]=3 999 B11R1.17 C=CCOc1cc[n]cc1Br Amb24486834 [0,1,0,0,0,0|2,0,0]=3 1000 B11R1.17 C=CCOc1cc[n]cc1I Amb25239642 [0,1,0,0,0,0|2,0,0]=3 1001 B11R1.17 C=CCOc1ccc[n]c1F Amb25318069 [0,1,0,0,0,0|2,0,0]=3 1002 B11R1.17 C=CCOc1cccc[n+]1[O-] Amb25083853 [0,1,0,0,0,0|2,0,0]=3 1003 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|1,0,0]=2 1004 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|1,0,0]=2 1005 B11R1.17 C=CCSc1[n]c[n]cc1Br Amb25082976 [0,1,0,0,0,0|3,0,0]=4 1006 B11R1.17 C=CCSc1[n]c[n]cc1I Amb25152003 [0,1,0,0,0,0|3,0,0]=4 1007 B11R1.17 C=CCSc1[n]cccc1Br Amb24486891 [0,1,0,0,0,0|2,0,0]=3 1008 B11R1.17 C=CCSc1[n]cccc1O Amb24666050 [0,1,0,0,0,0|2,0,0]=3 1009 B11R1.17 C=CCSc1c[n]ccc1N Amb25763119 [0,1,0,0,0,0|2,0,0]=3 1010 B11R1.17 C=CCSc1cc[n]cc1Br Amb24501891 [0,1,0,0,0,0|2,0,0]=3 1011 B11R1.17 C=CCSc1cccc[n+]1C Amb10553709 [0,1,0,0,0,0|2,0,0]=3 1012 B11R1.17 C=CCSc1cccc[n+]1C Amb10553733 [0,1,0,0,0,0|2,0,0]=3 1013 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|1,0,0]=2 1014 B11R1.17 C=CCSc1ccccc1N Amb22462667 [0,1,0,0,0,0|1,0,0]=2 1015 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|1,0,0]=2 1016 B11R1.17 C=COCc1ccccc1Br Amb25679589 [0,1,0,0,0,0|2,0,0]=3 1017 B11R1.17 C=COCc1ccccc1F Amb24569429 [0,1,0,0,0,0|2,0,0]=3 1018 B11R1.17 C=C\C=C\c1ccc[n]c1N Amb24624505 [0,1,0,0,0,0|2,0,1]=4 1019 B11R1.17 C=C\C=C\c1ccccc1N Amb18644207 [0,1,0,0,0,0|1,0,1]=3 1020 B11R1.17 C=C\C=C\c1ccccc1O Amb25142722 [0,1,0,0,0,0|1,0,1]=3 1021 B11R1.17 CC=CCc1ccccc1O Amb24089583 [0,1,0,0,0,0|1,0,2]=4 1022 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|1,0,2]=4 1023 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|1,0,2]=4 1024 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|1,0,2]=4 1025 B11R1.17 CCCNc1[n]cccc1Br Amb18292051 [0,1,0,0,0,0|1,0,2]=4 1026 B11R1.17 CCCNc1[n]cccc1F Amb18300627 [0,1,0,0,0,0|1,0,2]=4 1027 B11R1.17 CCCNc1[n]cccc1N Amb20668081 [0,1,0,0,0,0|1,0,2]=4 1028 B11R1.17 CCCNc1[n]cccc1N Amb24077822 [0,1,0,0,0,0|1,0,2]=4 1029 B11R1.17 CCCNc1c[n]ccc1N Amb24379469 [0,1,0,0,0,0|1,0,2]=4 1030 B11R1.17 CCCNc1c[n]ccc1O Amb24554848 [0,1,0,0,0,0|1,0,2]=4 1031 B11R1.17 CCCNc1cc[n]cc1Cl Amb24742794 [0,1,0,0,0,0|1,0,2]=4 1032 B11R1.17 CCCNc1cc[n]cc1N Amb24077829 [0,1,0,0,0,0|1,0,2]=4 1033 B11R1.17 CCCNc1ccc[n]c1N Amb23557985 [0,1,0,0,0,0|1,0,2]=4 1034 B11R1.17 CCCNc1ccccc1O Amb18644480 [0,1,0,0,0,0|0,0,2]=3 1035 B11R1.17 CCCOc1ccccc1Cl Amb25216415 [0,1,0,0,0,0|1,0,2]=4 1036 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,1,0,0,0,0|1,0,2]=4 1037 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,1,0,0,0,0|1,0,2]=4 1038 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,1,0,0,0,0|1,0,2]=4 1039 B11R1.17 CCCSc1ccccc1O Amb18177881 [0,1,0,0,0,0|1,0,2]=4 1040 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.17 CNCCc1ccccc1N Amb24106838 [0,1,0,0,0,0|2,0,1]=4 1042 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|2,0,1]=4 1043 B11R1.17 COCCc1ccccc1Cl Amb24518157 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.17 COCCc1ccccc1I Amb24483388 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.17 COCCc1ccccc1O Amb22055702 [0,1,0,0,0,0|2,0,1]=4 1047 B11R1.17 COCNc1ccc[n]c1Cl Amb25706148 [0,1,0,0,0,0|2,0,1]=4 1048 B11R1.17 COCNc1ccccc1F Amb24084241 [0,1,0,0,0,0|1,0,1]=3 1049 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,1,0,0,0,0|2,0,1]=4 1050 B11R1.17 COCOc1ccccc1C Amb10559613 [0,1,0,0,0,0|2,0,1]=4 1051 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,1,0,0,0,0|2,0,1]=4 1052 B11R1.17 COCOc1ccccc1F Amb22546792 [0,1,0,0,0,0|2,0,1]=4 1053 B11R1.17 COCOc1ccccc1I Amb22284514 [0,1,0,0,0,0|2,0,1]=4 1054 B11R1.17 COCOc1ccccc1N Amb23599107 [0,1,0,0,0,0|2,0,1]=4 1055 B11R1.17 COCOc1ccccc1O Amb24486480 [0,1,0,0,0,0|2,0,1]=4 1056 B11R1.17 COCSc1ccccc1N Amb17305638 [0,1,0,0,0,0|2,0,1]=4 1057 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [0,1,0,0,0,0|2,0,1]=4 1058 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.17 CSCNc1ccc[n]c1Cl Amb24424633 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.17 CSCOc1ccccc1Br Amb25358756 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.17 CSCOc1ccccc1Cl Amb24459326 [0,1,0,0,0,0|2,0,1]=4 1062 B11R1.17 CSCSc1ccccc1Br Amb24516501 [0,1,0,0,0,0|2,0,1]=4 1063 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [0,1,0,0,0,0|1,0,2]=4 1064 B11R1.17 C\C=C\Cc1ccccc1N Amb18644343 [0,1,0,0,0,0|1,0,2]=4 1065 B11R1.17 C\C=C\Oc1ccccc1O Amb25143344 [0,1,0,0,0,0|1,0,2]=4 1066 B11R1.17 Cc1[n]cc[n]c1NCC=C Amb25674934 [0,1,0,0,0,0|2,0,0]=3 1067 B11R1.17 Cc1[n]cccc1NCC#C Amb25149262 [0,1,0,0,0,0|1,0,2]=4 1068 B11R1.17 Cc1[n]cccc1NCCC Amb24386233 [0,1,0,0,0,0|1,0,2]=4 1069 B11R1.17 Cc1[n]cccc1OCC=C Amb25066204 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.17 Cc1c[n]ccc1CCC=C Amb24102788 [0,1,0,0,0,0|2,0,0]=3 1071 B11R1.17 Cc1c[n]ccc1NCC=C Amb25851134 [0,1,0,0,0,0|1,0,0]=2 1072 B11R1.17 Cc1c[n]ccc1NCCF Amb25850522 [0,1,0,0,0,0|2,0,1]=4 1073 B11R1.17 Cc1c[n]ccc1NCCO Amb24689647 [0,1,0,0,0,0|2,0,1]=4 1074 B11R1.17 Cc1cc[n]cc1NCC#C Amb25760615 [0,1,0,0,0,0|1,0,2]=4 1075 B11R1.17 Cc1ccc[n]c1CCC=C Amb24100504 [0,1,0,0,0,0|2,0,0]=3 1076 B11R1.17 Cc1ccc[n]c1NCC#C Amb18959732 [0,1,0,0,0,0|1,0,2]=4 1077 B11R1.17 Cc1ccc[n]c1NCC=C Amb18987756 [0,1,0,0,0,0|1,0,0]=2 1078 B11R1.17 Cc1ccc[n]c1NCCC Amb18987728 [0,1,0,0,0,0|1,0,2]=4 1079 B11R1.17 Cc1ccc[n]c1NCCF Amb25152259 [0,1,0,0,0,0|2,0,1]=4 1080 B11R1.17 Cc1ccc[n]c1NCCO Amb18987733 [0,1,0,0,0,0|2,0,1]=4 1081 B11R1.17 Cc1ccccc1C#CC=O Amb18635840 [0,1,0,0,0,0|2,0,1]=4 1082 B11R1.17 Cc1ccccc1CCC#C Amb18636111 [0,1,0,0,0,0|1,0,2]=4 1083 B11R1.17 Cc1ccccc1CCCC Amb25825024 [0,1,0,0,0,0|1,0,2]=4 1084 B11R1.17 Cc1ccccc1CCNC Amb19959980 [0,1,0,0,0,0|2,0,1]=4 1085 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,0,0,0,0|3,0,0]=4 1087 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,0,0,0,0|3,0,0]=4 1088 B11R1.17 Cc1ccccc1C\C=C\Cl Amb25109327 [0,1,0,0,0,0|2,0,1]=4 1089 B11R1.17 Cc1ccccc1NCC#C Amb25677805 [0,1,0,0,0,0|0,0,2]=3 1090 B11R1.17 Cc1ccccc1NCCF Amb24560861 [0,1,0,0,0,0|1,0,1]=3 1091 B11R1.17 Cc1ccccc1NCOC Amb25690923 [0,1,0,0,0,0|1,0,1]=3 1092 B11R1.17 Cc1ccccc1OCC#C Amb19373366 [0,1,0,0,0,0|1,0,2]=4 1093 B11R1.17 Cc1ccccc1O\C=C/Cl Amb25796451 [0,1,0,0,0,0|2,0,1]=4 1094 B11R1.17 Cc1ccccc1SCC#C Amb18788142 [0,1,0,0,0,0|1,0,2]=4 1095 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,1,0,0,0,0|2,0,1]=4 1096 B11R1.17 Cc1ccccc1SCC=C Amb25231651 [0,1,0,0,0,0|1,0,0]=2 1097 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|2,0,0]=3 1098 B11R1.17 Cc1ccccc1SCCC Amb24674923 [0,1,0,0,0,0|1,0,2]=4 1099 B11R1.17 Cc1ccccc1SCCCl Amb19059017 [0,1,0,0,0,0|2,0,1]=4 1100 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,1,0,0,0,0|2,0,1]=4 1101 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|2,0,1]=4 1102 B11R1.17 Cc1ccccc1SCSC Amb24631994 [0,1,0,0,0,0|2,0,1]=4 1103 B11R1.17 ClCCCc1ccccc1C Amb17104525 [0,1,0,0,0,0|2,0,1]=4 1104 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|2,0,1]=4 1105 B11R1.17 ClCCCc1ccccc1F Amb17104528 [0,1,0,0,0,0|2,0,1]=4 1106 B11R1.17 ClCCCc1ccccc1N Amb17477710 [0,1,0,0,0,0|2,0,1]=4 1107 B11R1.17 ClCCCc1ccccc1O Amb17477721 [0,1,0,0,0,0|2,0,1]=4 1108 B11R1.17 ClCCNc1[n]cccc1Br Amb25846546 [0,1,0,0,0,0|2,0,1]=4 1109 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,1,0,0,0,0|1,0,1]=3 1110 B11R1.17 ClCCNc1ccccc1C Amb17334785 [0,1,0,0,0,0|1,0,1]=3 1111 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,1,0,0,0,0|1,0,1]=3 1112 B11R1.17 ClCCNc1ccccc1F Amb17334964 [0,1,0,0,0,0|1,0,1]=3 1113 B11R1.17 ClCCSc1ccccc1F Amb1154202 [0,1,0,0,0,0|2,0,1]=4 1114 B11R1.17 Clc1c[n]ccc1NCCCl Amb25225122 [0,1,0,0,0,0|2,0,1]=4 1115 B11R1.17 Clc1ccc[n]c1NCCCl Amb25144899 [0,1,0,0,0,0|2,0,1]=4 1116 B11R1.17 Clc1ccccc1CC[Zn]Br Amb22898141 [0,1,0,0,0,0|3,0,0]=4 1117 B11R1.17 Clc1ccccc1CC[Zn]Cl Amb22897727 [0,1,0,0,0,0|3,0,0]=4 1118 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,1,0,0,0,0|2,0,1]=4 1119 B11R1.17 Fc1ccc[n]c1NCCF Amb24425884 [0,1,0,0,0,0|2,0,1]=4 1120 B11R1.17 Fc1ccccc1OCCF Amb25692641 [0,1,0,0,0,0|2,0,1]=4 1121 B11R1.17 Fc1ccccc1OCCI Amb25151268 [0,1,0,0,0,0|2,0,1]=4 1122 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|2,0,1]=4 1123 B11R1.17 N#CCCc1ccccc1C Amb17204295 [0,1,0,0,0,0|2,0,1]=4 1124 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|2,0,1]=4 1125 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|2,0,1]=4 1126 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,1,0,0,0,0|2,0,1]=4 1127 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|2,0,1]=4 1128 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|2,0,1]=4 1129 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|2,0,1]=4 1130 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|2,0,1]=4 1131 B11R1.17 NCCNc1[n]cccc1Br Amb18979379 [0,1,0,0,0,0|2,0,1]=4 1132 B11R1.17 NCCNc1[n]cccc1F Amb18996005 [0,1,0,0,0,0|2,0,1]=4 1133 B11R1.17 NCCNc1cc[n]cc1Br Amb24768461 [0,1,0,0,0,0|2,0,1]=4 1134 B11R1.17 NCCNc1cc[n]cc1F Amb24739193 [0,1,0,0,0,0|2,0,1]=4 1135 B11R1.17 NCCNc1ccc[n]c1Br Amb24729303 [0,1,0,0,0,0|2,0,1]=4 1136 B11R1.17 NCCNc1ccc[n]c1Cl Amb25187389 [0,1,0,0,0,0|2,0,1]=4 1137 B11R1.17 NCCNc1cccc[n+]1[O-] Amb24726506 [0,1,0,0,0,0|2,0,1]=4 1138 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,1,0,0,0,0|1,0,1]=3 1139 B11R1.17 NCCNc1ccccc1C Amb17057744 [0,1,0,0,0,0|1,0,1]=3 1140 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,1,0,0,0,0|1,0,1]=3 1141 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,1,0,0,0,0|1,0,1]=3 1142 B11R1.17 NCCNc1ccccc1N Amb1397489 [0,1,0,0,0,0|1,0,1]=3 1143 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,1,0,0,0,0|1,0,1]=3 1144 B11R1.17 NCCNc1ncccc1C Amb10607838 [0,1,0,0,0,0|2,0,1]=4 1145 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,1,0,0,0,0|2,0,1]=4 1146 B11R1.17 NCCOc1ccccc1C Amb1098984 [0,1,0,0,0,0|2,0,1]=4 1147 B11R1.17 NCCOc1ccccc1C Amb2052283 [0,1,0,0,0,0|2,0,1]=4 1148 B11R1.17 NCCOc1ccccc1Cl Amb2137131 [0,1,0,0,0,0|2,0,1]=4 1149 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,1,0,0,0,0|2,0,1]=4 1150 B11R1.17 NCCOc1ccccc1O Amb17615721 [0,1,0,0,0,0|2,0,1]=4 1151 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,1,0,0,0,0|2,0,1]=4 1152 B11R1.17 NNCCc1ccccc1Br Amb24701935 [0,1,0,0,0,0|3,0,0]=4 1153 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.17 Nc1[n]cccc1CCC=O Amb25244379 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.17 Nc1[n]cccc1NCCF Amb25744595 [0,1,0,0,0,0|2,0,1]=4 1159 B11R1.17 Nc1[n]cccc1NCCN Amb24486768 [0,1,0,0,0,0|2,0,1]=4 1160 B11R1.17 Nc1[n]cccc1NNC=O Amb18125378 [0,1,0,0,0,0|3,0,0]=4 1161 B11R1.17 Nc1c[n]ccc1NCCF Amb24406413 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.17 Nc1c[n]ccc1NCCN Amb18991504 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.17 Nc1cc[n]cc1CCC=O Amb25742213 [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.17 Nc1cc[n]cc1NCCN Amb25682895 [0,1,0,0,0,0|2,0,1]=4 1165 B11R1.17 Nc1ccc[n]c1NCCN Amb18991500 [0,1,0,0,0,0|2,0,1]=4 1166 B11R1.17 Nc1ccccc1CCC#N Amb18124793 [0,1,0,0,0,0|2,0,1]=4 1167 B11R1.17 Nc1ccccc1CCC=O Amb25208520 [0,1,0,0,0,0|2,0,0]=3 1168 B11R1.17 Nc1ccccc1CCCBr Amb22228093 [0,1,0,0,0,0|2,0,1]=4 1169 B11R1.17 Nc1ccccc1CCCBr Amb25217893 [0,1,0,0,0,0|2,0,1]=4 1170 B11R1.17 Nc1ccccc1CNC=O Amb24096445 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.17 Nc1ccccc1NOP=O Amb24653832 [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,1,0,0,0,0|2,0,1]=4 1173 B11R1.17 Nc1ccccc1OCCN Amb18251366 [0,1,0,0,0,0|2,0,1]=4 1174 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,1,0,0,0,0|2,0,1]=4 1175 B11R1.17 Nc1ccccc1SCCF Amb24533142 [0,1,0,0,0,0|2,0,1]=4 1176 B11R1.17 Nc1ccccc1SCCN Amb18291073 [0,1,0,0,0,0|2,0,1]=4 1177 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [0,1,0,0,0,0|2,0,1]=4 1178 B11R1.17 Nc1ncccc1OCC=C Amb10608175 [0,1,0,0,0,0|2,0,0]=3 1179 B11R1.17 O=C/1C=CC=C\C1=C\NC=O Amb24518470 [0,1,0,0,0,0|3,0,0]=4 1180 B11R1.17 O=CC#Cc1ccccc1Br Amb18635851 [0,1,0,0,0,0|2,0,1]=4 1181 B11R1.17 O=CC#Cc1ccccc1Cl Amb18635604 [0,1,0,0,0,0|2,0,1]=4 1182 B11R1.17 O=CC#Cc1ccccc1F Amb18117458 [0,1,0,0,0,0|2,0,1]=4 1183 B11R1.17 O=CCCN1C=CC=CC1=O Amb18177171 [0,1,0,0,0,0|3,0,0]=4 1184 B11R1.17 O=CCCc1[n]cccc1Cl Amb25336372 [0,1,0,0,0,0|3,0,0]=4 1185 B11R1.17 O=CCCc1cc[n]cc1F Amb25677089 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|2,0,0]=3 1187 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.17 O=CCCc1ccccc1I Amb24093007 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.17 O=CCCc1ccccc1S Amb25325144 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,0,0,0,0|3,0,0]=4 1196 B11R1.17 O=CNCc1ccccc1F Amb25369873 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.17 O=C\C=C/c1ccccc1S Amb24638879 [0,1,0,0,0,0|2,0,1]=4 1198 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,1,0,0,0,0|2,0,1]=4 1199 B11R1.17 O=C\C=C\c1ccccc1C Amb17232007 [0,1,0,0,0,0|2,0,1]=4 1200 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|2,0,1]=4 1203 B11R1.17 OCCCc1ccccc1C Amb17089494 [0,1,0,0,0,0|2,0,1]=4 1204 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|2,0,1]=4 1205 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|2,0,1]=4 1206 B11R1.17 OCCCc1ccccc1N Amb17477702 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.17 OCCNc1[n]cccc1Br Amb18292072 [0,1,0,0,0,0|2,0,1]=4 1209 B11R1.17 OCCNc1[n]cccc1F Amb18300634 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.17 OCCNc1ncccc1I Amb10844707 [0,1,0,0,0,0|2,0,1]=4 1211 B11R1.17 OCCOc1ccccc1C Amb2209345 [0,1,0,0,0,0|2,0,1]=4 1212 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|2,0,1]=4 1213 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|2,0,1]=4 1214 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|2,0,1]=4 1215 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [0,1,0,0,0,0|2,0,0]=3 1216 B11R1.17 Oc1ccccc1CCCF Amb24100539 [0,1,0,0,0,0|2,0,1]=4 1217 B11R1.17 Oc1ccccc1C\C=C/Cl Amb24578313 [0,1,0,0,0,0|2,0,1]=4 1218 B11R1.17 Oc1ccccc1C\C=C\Cl Amb18647090 [0,1,0,0,0,0|2,0,1]=4 1219 B11R1.17 Oc1ccccc1NCC=O Amb24096359 [0,1,0,0,0,0|1,0,0]=2 1220 B11R1.17 Oc1ccccc1NCCO Amb18644558 [0,1,0,0,0,0|1,0,1]=3 1221 B11R1.17 Oc1ccccc1OCCBr Amb25189201 [0,1,0,0,0,0|2,0,1]=4 1222 B11R1.17 Oc1ccccc1SCC=O Amb25290203 [0,1,0,0,0,0|2,0,0]=3 1223 B11R1.17 Oc1ccccc1SCCO Amb18177935 [0,1,0,0,0,0|2,0,1]=4 1224 B11R1.17 Oc1ccccc1\C=N\C=O Amb24422424 [0,1,0,0,0,0|3,0,0]=4 1225 B11R1.17 Oc1ccccc1\N=C\C=O Amb24759135 [0,1,0,0,0,0|1,0,2]=4 1226 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|2,0,1]=4 1227 B11R1.17 SCCCc1ccccc1C Amb17400218 [0,1,0,0,0,0|2,0,1]=4 1228 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|2,0,1]=4 1229 B11R1.17 SCCCc1ccccc1F Amb17400332 [0,1,0,0,0,0|2,0,1]=4 1230 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.17 SCCSc1ccccc1Br Amb25306099 [0,1,0,0,0,0|2,0,1]=4 1232 B11R1.17 Sc1ccccc1CCCBr Amb25196016 [0,1,0,0,0,0|2,0,1]=4 1233 B11R1.17 Sc1ccccc1NCCS Amb25118736 [0,1,0,0,0,0|1,0,1]=3 1234 B11R1.17 [C-]#[N+]CCc1ccccc1O Amb24644224 [0,1,0,0,0,0|2,0,1]=4 1235 B11R1.24 BrCCCc1cccc(c1)Br Amb17104576 [0,1,0,0,0,0|2,0,1]=4 1236 B11R1.24 BrCCCc1cccc(c1)C Amb17104553 [0,1,0,0,0,0|2,0,1]=4 1237 B11R1.24 BrCCCc1cccc(c1)Cl Amb17104561 [0,1,0,0,0,0|2,0,1]=4 1238 B11R1.24 BrCCOc1cccc(c1)Br Amb1150981 [0,1,0,0,0,0|2,0,1]=4 1239 B11R1.24 BrCCOc1cccc(c1)C Amb1643479 [0,1,0,0,0,0|2,0,1]=4 1240 B11R1.24 BrCCOc1cccc(c1)Cl Amb1152965 [0,1,0,0,0,0|2,0,1]=4 1241 B11R1.24 Br[Zn]CCc1cccc(c1)Br Amb13890856 [0,1,0,0,0,0|3,0,0]=4 1242 B11R1.24 Brc1cc(ccc1)OCCI Amb25151269 [0,1,0,0,0,0|2,0,1]=4 1243 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|1,0,2]=4 1244 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|1,0,2]=4 1245 B11R1.24 C#CCNc1c[n]cc(Br)c1 Amb24716754 [0,1,0,0,0,0|1,0,2]=4 1246 B11R1.24 C#CCNc1cc(N)cc[n]1 Amb25230495 [0,1,0,0,0,0|1,0,2]=4 1247 B11R1.24 C#CCNc1cc[n]c(Cl)c1 Amb24353797 [0,1,0,0,0,0|1,0,2]=4 1248 B11R1.24 C#CCNc1cccc(Br)[n]1 Amb25800719 [0,1,0,0,0,0|1,0,2]=4 1249 B11R1.24 C#CCNc1cccc(Cl)[n]1 Amb24429362 [0,1,0,0,0,0|1,0,2]=4 1250 B11R1.24 C#CCNc1cccc(Cl)c1 Amb18800989 [0,1,0,0,0,0|0,0,2]=3 1251 B11R1.24 C#CCNc1cccc(F)c1 Amb24102181 [0,1,0,0,0,0|0,0,2]=3 1252 B11R1.24 C#CCNc1cccc(I)c1 Amb25312865 [0,1,0,0,0,0|0,0,2]=3 1253 B11R1.24 C#CCNc1cccc(N)[n]1 Amb24398319 [0,1,0,0,0,0|1,0,2]=4 1254 B11R1.24 C#CCNc1cccc(O)c1 Amb25138473 [0,1,0,0,0,0|0,0,2]=3 1255 B11R1.24 C#CCOc1cccc(Cl)c1 Amb18183541 [0,1,0,0,0,0|1,0,2]=4 1256 B11R1.24 C#CCOc1cccc(F)c1 Amb18182728 [0,1,0,0,0,0|1,0,2]=4 1257 B11R1.24 C#CCOc1cccc(c1)N Amb13783680 [0,1,0,0,0,0|1,0,2]=4 1258 B11R1.24 C#CCSc1cccc(Cl)c1 Amb19068162 [0,1,0,0,0,0|1,0,2]=4 1259 B11R1.24 C#CCSc1cccc(N)c1 Amb25675317 [0,1,0,0,0,0|1,0,2]=4 1260 B11R1.24 C#CCSc1cccc(O)c1 Amb24657054 [0,1,0,0,0,0|1,0,2]=4 1261 B11R1.24 C=CCCC1=CC=CC(=O)N1 Amb25849768 [0,1,0,0,0,0|2,0,0]=3 1262 B11R1.24 C=CCCc1cc[n]c(N)c1 Amb24378060 [0,1,0,0,0,0|2,0,0]=3 1263 B11R1.24 C=CCCc1cccc(N)[n]1 Amb25189109 [0,1,0,0,0,0|2,0,0]=3 1264 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|1,0,0]=2 1265 B11R1.24 C=CCNC1=CC(=O)NC=N1 Amb24401304 [0,1,0,0,0,0|2,0,0]=3 1266 B11R1.24 C=CCNC=1C=NNC(=O)N1 Amb19117035 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.24 C=CCNC=1NN=CC(=O)N1 Amb25222954 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.24 C=CCNc1c[n]cc(Br)c1 Amb24528876 [0,1,0,0,0,0|1,0,0]=2 1269 B11R1.24 C=CCNc1c[n]cc(Cl)[n]1 Amb21958699 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.24 C=CCNc1cc(Cl)[n]c[n]1 Amb21958698 [0,1,0,0,0,0|2,0,0]=3 1271 B11R1.24 C=CCNc1cc(N)[n]c[n]1 Amb24073575 [0,1,0,0,0,0|2,0,0]=3 1272 B11R1.24 C=CCNc1cc[n]c(N)[n]1 Amb24073484 [0,1,0,0,0,0|2,0,0]=3 1273 B11R1.24 C=CCNc1cc[n]c(N)c1 Amb24731977 [0,1,0,0,0,0|1,0,0]=2 1274 B11R1.24 C=CCNc1cccc(Cl)[n]1 Amb21958701 [0,1,0,0,0,0|1,0,0]=2 1275 B11R1.24 C=CCNc1cccc(F)[n]1 Amb25066907 [0,1,0,0,0,0|1,0,0]=2 1276 B11R1.24 C=CCNc1cccc(N)[n]1 Amb25701328 [0,1,0,0,0,0|1,0,0]=2 1277 B11R1.24 C=CCNc1cccc(c1)Br Amb17306222 [0,1,0,0,0,0|0,0,0]=1 1278 B11R1.24 C=CCNc1cccc(c1)C Amb17306547 [0,1,0,0,0,0|0,0,0]=1 1279 B11R1.24 C=CCNc1cccc(c1)Cl Amb17307127 [0,1,0,0,0,0|0,0,0]=1 1280 B11R1.24 C=CCNc1cccc(c1)F Amb17306228 [0,1,0,0,0,0|0,0,0]=1 1281 B11R1.24 C=CCOc1c[n]cc(Br)c1 Amb25128103 [0,1,0,0,0,0|2,0,0]=3 1282 B11R1.24 C=CCOc1c[n]cc(N)[n]1 Amb25724313 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.24 C=CCOc1c[n]cc(N)c1 Amb24486698 [0,1,0,0,0,0|2,0,0]=3 1284 B11R1.24 C=CCOc1cc(Cl)[n]c[n]1 Amb18177960 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.24 C=CCOc1cc(N)[n]c[n]1 Amb25781039 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.24 C=CCOc1cc[n]c(Cl)[n]1 Amb18183622 [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.24 C=CCOc1cc[n]c(Cl)c1 Amb25145756 [0,1,0,0,0,0|2,0,0]=3 1288 B11R1.24 C=CCOc1cc[n]c(F)c1 Amb24572940 [0,1,0,0,0,0|2,0,0]=3 1289 B11R1.24 C=CCOc1cc[n]c(N)[n]1 Amb25169277 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.24 C=CCOc1cccc(Cl)[n]1 Amb24642240 [0,1,0,0,0,0|2,0,0]=3 1291 B11R1.24 C=CCOc1cccc(F)[n]1 Amb18177246 [0,1,0,0,0,0|2,0,0]=3 1292 B11R1.24 C=CCOc1cccc(F)c1 Amb24649594 [0,1,0,0,0,0|1,0,0]=2 1293 B11R1.24 C=CCOc1cccc(I)c1 Amb22896684 [0,1,0,0,0,0|1,0,0]=2 1294 B11R1.24 C=CCOc1cccc(N)[n]1 Amb25189199 [0,1,0,0,0,0|2,0,0]=3 1295 B11R1.24 C=CCOc1cccc(c1)N Amb2094493 [0,1,0,0,0,0|1,0,0]=2 1296 B11R1.24 C=CCSC=1NC(=O)C=CN1 Amb21998055 [0,1,0,0,0,0|3,0,0]=4 1297 B11R1.24 C=CCSc1cc(Cl)[n]c[n]1 Amb24502013 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.24 C=CCSc1cc(F)[n]c[n]1 Amb25687030 [0,1,0,0,0,0|3,0,0]=4 1299 B11R1.24 C=CCSc1cc(N)cc[n]1 Amb25764111 [0,1,0,0,0,0|2,0,0]=3 1300 B11R1.24 C=CCSc1cc[n]c(Cl)c1 Amb24681959 [0,1,0,0,0,0|2,0,0]=3 1301 B11R1.24 C=CCSc1cc[n]c(F)c1 Amb24367430 [0,1,0,0,0,0|2,0,0]=3 1302 B11R1.24 C=CCSc1cc[n]c(N)c1 Amb25151939 [0,1,0,0,0,0|2,0,0]=3 1303 B11R1.24 C=CCSc1cccc(Br)[n]1 Amb25070280 [0,1,0,0,0,0|2,0,0]=3 1304 B11R1.24 C=CCSc1cccc(N)c1 Amb24707774 [0,1,0,0,0,0|1,0,0]=2 1305 B11R1.24 C=C\C=C\c1cccc(Cl)c1 Amb25221723 [0,1,0,0,0,0|1,0,1]=3 1306 B11R1.24 C=C\C=C\c1cccc(F)c1 Amb24485865 [0,1,0,0,0,0|1,0,1]=3 1307 B11R1.24 C=C\C=C\c1cccc(O)c1 Amb25176416 [0,1,0,0,0,0|1,0,1]=3 1308 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|1,0,2]=4 1309 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|1,0,2]=4 1310 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [0,1,0,0,0,0|1,0,2]=4 1311 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [0,1,0,0,0,0|1,0,2]=4 1312 B11R1.24 CCCNc1cc(Br)c[n]c1 Amb23450119 [0,1,0,0,0,0|1,0,2]=4 1313 B11R1.24 CCCNc1cc(Br)cc[n]1 Amb19959557 [0,1,0,0,0,0|1,0,2]=4 1314 B11R1.24 CCCNc1cc(Cl)c[n]c1 Amb25312529 [0,1,0,0,0,0|1,0,2]=4 1315 B11R1.24 CCCNc1cc(F)c[n]c1 Amb25151999 [0,1,0,0,0,0|1,0,2]=4 1316 B11R1.24 CCCNc1cc(N)[n]cc1 Amb25341378 [0,1,0,0,0,0|1,0,2]=4 1317 B11R1.24 CCCNc1cc(N)c[n]c1 Amb24468291 [0,1,0,0,0,0|1,0,2]=4 1318 B11R1.24 CCCNc1cc(N)ccn1 Amb17334314 [0,1,0,0,0,0|1,0,2]=4 1319 B11R1.24 CCCNc1cc(O)cc[n]1 Amb25678446 [0,1,0,0,0,0|1,0,2]=4 1320 B11R1.24 CCCNc1cccc(Br)[n]1 Amb22831396 [0,1,0,0,0,0|1,0,2]=4 1321 B11R1.24 CCCNc1cccc(Br)[n]1 Amb25145786 [0,1,0,0,0,0|1,0,2]=4 1322 B11R1.24 CCCNc1cccc(Cl)[n]1 Amb21958678 [0,1,0,0,0,0|1,0,2]=4 1323 B11R1.24 CCCNc1cccc(F)[n]1 Amb18973532 [0,1,0,0,0,0|1,0,2]=4 1324 B11R1.24 CCCNc1cccc(O)[n]1 Amb25850757 [0,1,0,0,0,0|1,0,2]=4 1325 B11R1.24 CCCOc1cc(Cl)ccc1 Amb25787001 [0,1,0,0,0,0|1,0,2]=4 1326 B11R1.24 CCCOc1cc(F)ccc1 Amb25700428 [0,1,0,0,0,0|1,0,2]=4 1327 B11R1.24 CCCOc1cccc(c1)C Amb10573406 [0,1,0,0,0,0|1,0,2]=4 1328 B11R1.24 CCCOc1cccc(c1)N Amb1138945 [0,1,0,0,0,0|1,0,2]=4 1329 B11R1.24 CCCSc1cc(Br)ccc1 Amb24538191 [0,1,0,0,0,0|1,0,2]=4 1330 B11R1.24 CCCSc1cc(Cl)ccc1 Amb25801816 [0,1,0,0,0,0|1,0,2]=4 1331 B11R1.24 CCCSc1cc(F)ccc1 Amb25806371 [0,1,0,0,0,0|1,0,2]=4 1332 B11R1.24 CCCSc1cc(N)ccc1 Amb18289141 [0,1,0,0,0,0|1,0,2]=4 1333 B11R1.24 CCCSc1cc(O)ccc1 Amb18126556 [0,1,0,0,0,0|1,0,2]=4 1334 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [0,1,0,0,0,0|2,0,1]=4 1335 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|2,0,1]=4 1336 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|2,0,1]=4 1337 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [0,1,0,0,0,0|2,0,1]=4 1338 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [0,1,0,0,0,0|2,0,1]=4 1339 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [0,1,0,0,0,0|2,0,1]=4 1340 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|2,0,1]=4 1341 B11R1.24 COCNc1cccc(F)c1 Amb24102182 [0,1,0,0,0,0|1,0,1]=3 1342 B11R1.24 COCOc1cc(Br)ccc1 Amb25810590 [0,1,0,0,0,0|2,0,1]=4 1343 B11R1.24 COCOc1cc(Cl)ccc1 Amb24551706 [0,1,0,0,0,0|2,0,1]=4 1344 B11R1.24 COCOc1cc(F)ccc1 Amb21858121 [0,1,0,0,0,0|2,0,1]=4 1345 B11R1.24 COCOc1cc(N)ccc1 Amb25096531 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.24 COCSc1cccc(Cl)c1 Amb24706398 [0,1,0,0,0,0|2,0,1]=4 1347 B11R1.24 COCSc1cccc(N)c1 Amb24532948 [0,1,0,0,0,0|2,0,1]=4 1348 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [0,1,0,0,0,0|2,0,1]=4 1349 B11R1.24 CSCOc1cccc(Cl)c1 Amb24516553 [0,1,0,0,0,0|2,0,1]=4 1350 B11R1.24 CSCSc1cc(Cl)ccc1 Amb24631399 [0,1,0,0,0,0|2,0,1]=4 1351 B11R1.24 Cc1[n]c(cc[n]1)NCC=C Amb18997379 [0,1,0,0,0,0|2,0,0]=3 1352 B11R1.24 Cc1[n]c(cc[n]1)OCC=C Amb24102912 [0,1,0,0,0,0|3,0,0]=4 1353 B11R1.24 Cc1cc(CCC=C)[n]cc1 Amb24104089 [0,1,0,0,0,0|2,0,0]=3 1354 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [0,1,0,0,0,0|3,0,0]=4 1355 B11R1.24 Cc1cc(NCC#C)[n]cc1 Amb18959032 [0,1,0,0,0,0|1,0,2]=4 1356 B11R1.24 Cc1cc(NCC=C)[n]c[n]1 Amb18295599 [0,1,0,0,0,0|2,0,0]=3 1357 B11R1.24 Cc1cc(NCC=C)[n]cc1 Amb18295663 [0,1,0,0,0,0|1,0,0]=2 1358 B11R1.24 Cc1cc(NCCBr)[n]cc1 Amb25798519 [0,1,0,0,0,0|2,0,1]=4 1359 B11R1.24 Cc1cc(NCCCl)[n]cc1 Amb25374118 [0,1,0,0,0,0|2,0,1]=4 1360 B11R1.24 Cc1cc(NCCN)ncc1 Amb10607842 [0,1,0,0,0,0|2,0,1]=4 1361 B11R1.24 Cc1cc(NCCO)[n]cc1 Amb18981411 [0,1,0,0,0,0|2,0,1]=4 1362 B11R1.24 Cc1cc(NCCO)[n]cc1 Amb19374562 [0,1,0,0,0,0|2,0,1]=4 1363 B11R1.24 Cc1cc(NCCS)[n]cc1 Amb25189649 [0,1,0,0,0,0|2,0,1]=4 1364 B11R1.24 Cc1cc([n]cc1)SCC=C Amb24463744 [0,1,0,0,0,0|2,0,0]=3 1365 B11R1.24 Cc1cc(\C=C\C=C)ccc1 Amb24604764 [0,1,0,0,0,0|1,0,1]=3 1366 B11R1.24 Cc1cc(c[n]c1)NCCN Amb24731510 [0,1,0,0,0,0|2,0,1]=4 1367 B11R1.24 Cc1cc(cc[n]1)NCC#C Amb24624989 [0,1,0,0,0,0|1,0,2]=4 1368 B11R1.24 Cc1cc(cc[n]1)NCC=C Amb24488422 [0,1,0,0,0,0|1,0,0]=2 1369 B11R1.24 Cc1cc(cc[n]1)NCCF Amb25152258 [0,1,0,0,0,0|2,0,1]=4 1370 B11R1.24 Cc1cc(cc[n]1)NCCN Amb24383516 [0,1,0,0,0,0|2,0,1]=4 1371 B11R1.24 Cc1cc(ccc1)C#CC=O Amb18117766 [0,1,0,0,0,0|2,0,1]=4 1372 B11R1.24 Cc1cc(ccc1)OCC#C Amb19373318 [0,1,0,0,0,0|1,0,2]=4 1373 B11R1.24 Cc1cc(ccc1)OCC=C Amb25688938 [0,1,0,0,0,0|1,0,0]=2 1374 B11R1.24 Cc1cc(ccc1)OCCF Amb25711593 [0,1,0,0,0,0|2,0,1]=4 1375 B11R1.24 Cc1cc(ccc1)SCC#C Amb18788143 [0,1,0,0,0,0|1,0,2]=4 1376 B11R1.24 Cc1cc(ccc1)SCC#N Amb18788233 [0,1,0,0,0,0|2,0,1]=4 1377 B11R1.24 Cc1cc(ccc1)SCCBr Amb24753608 [0,1,0,0,0,0|2,0,1]=4 1378 B11R1.24 Cc1cc(ccc1)SCCCl Amb18316731 [0,1,0,0,0,0|2,0,1]=4 1379 B11R1.24 Cc1cc(ccc1)SCCF Amb25307210 [0,1,0,0,0,0|2,0,1]=4 1380 B11R1.24 Cc1cc[n]c(NCC=C)[n]1 Amb18302209 [0,1,0,0,0,0|2,0,0]=3 1381 B11R1.24 Cc1cc[n]c([n]1)SCC=C Amb24619761 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.24 Cc1cc[n]c(c1)NCCC Amb18293521 [0,1,0,0,0,0|1,0,2]=4 1383 B11R1.24 Cc1cccc(CCC=C)[n]1 Amb24100506 [0,1,0,0,0,0|2,0,0]=3 1384 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [0,1,0,0,0,0|1,0,2]=4 1385 B11R1.24 Cc1cccc(NCC#C)[n]1 Amb18284775 [0,1,0,0,0,0|1,0,2]=4 1386 B11R1.24 Cc1cccc(NCC=C)[n]1 Amb18295551 [0,1,0,0,0,0|1,0,0]=2 1387 B11R1.24 Cc1cccc(NCCCl)[n]1 Amb25846545 [0,1,0,0,0,0|2,0,1]=4 1388 B11R1.24 Cc1cccc(NCCF)[n]1 Amb25274531 [0,1,0,0,0,0|2,0,1]=4 1389 B11R1.24 Cc1cccc(NCCN)[n]1 Amb18970380 [0,1,0,0,0,0|2,0,1]=4 1390 B11R1.24 Cc1cccc(NCCN)[n]1 Amb19440303 [0,1,0,0,0,0|2,0,1]=4 1391 B11R1.24 Cc1cccc(NCCO)[n]1 Amb18290373 [0,1,0,0,0,0|2,0,1]=4 1392 B11R1.24 Cc1cccc(NCCS)[n]1 Amb25065548 [0,1,0,0,0,0|2,0,1]=4 1393 B11R1.24 Cc1cccc([n]1)OCC=C Amb25752190 [0,1,0,0,0,0|2,0,0]=3 1394 B11R1.24 Cc1cccc(c1)SCOC Amb25235859 [0,1,0,0,0,0|2,0,1]=4 1395 B11R1.24 ClCCCc1cccc(I)c1 Amb25239109 [0,1,0,0,0,0|2,0,1]=4 1396 B11R1.24 ClCCCc1cccc(c1)Br Amb17104548 [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.24 ClCCCc1cccc(c1)C Amb17104526 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.24 ClCCCc1cccc(c1)Cl Amb17104534 [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.24 ClCCCc1cccc(c1)N Amb17477709 [0,1,0,0,0,0|2,0,1]=4 1400 B11R1.24 ClCCCc1cccc(c1)O Amb17477723 [0,1,0,0,0,0|2,0,1]=4 1401 B11R1.24 ClCCNc1cccc(c1)Br Amb17346197 [0,1,0,0,0,0|1,0,1]=3 1402 B11R1.24 ClCCNc1cccc(c1)C Amb17334786 [0,1,0,0,0,0|1,0,1]=3 1403 B11R1.24 ClCCNc1cccc(c1)Cl Amb17336181 [0,1,0,0,0,0|1,0,1]=3 1404 B11R1.24 ClCCNc1cccc(c1)F Amb17334966 [0,1,0,0,0,0|1,0,1]=3 1405 B11R1.24 ClCCOc1cccc(c1)N Amb10608112 [0,1,0,0,0,0|2,0,1]=4 1406 B11R1.24 Clc1cc(ccc1)OCCI Amb25334122 [0,1,0,0,0,0|2,0,1]=4 1407 B11R1.24 Clc1cccc(c1)SCCCl Amb25857042 [0,1,0,0,0,0|2,0,1]=4 1408 B11R1.24 Clc1cccc(n1)NNC=O Amb10067842 [0,1,0,0,0,0|3,0,0]=4 1409 B11R1.24 FCCNc1cc(Br)cc[n]1 Amb25852545 [0,1,0,0,0,0|2,0,1]=4 1410 B11R1.24 FCCNc1cc(Br)ccc1 Amb25307539 [0,1,0,0,0,0|1,0,1]=3 1411 B11R1.24 FCCNc1cc(Cl)ccc1 Amb24427077 [0,1,0,0,0,0|1,0,1]=3 1412 B11R1.24 FCCOc1cc(Br)ccc1 Amb22227889 [0,1,0,0,0,0|2,0,1]=4 1413 B11R1.24 FCCOc1cc(Cl)ccc1 Amb24659046 [0,1,0,0,0,0|2,0,1]=4 1414 B11R1.24 FCCSc1cc(Cl)ccc1 Amb25266256 [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.24 Fc1cc(CCCBr)ccc1 Amb22886712 [0,1,0,0,0,0|2,0,1]=4 1416 B11R1.24 Fc1cc(CCCCl)ccc1 Amb18803316 [0,1,0,0,0,0|2,0,1]=4 1417 B11R1.24 Fc1cc(CCCS)ccc1 Amb18065480 [0,1,0,0,0,0|2,0,1]=4 1418 B11R1.24 Fc1cc(CC[Zn]Br)ccc1 Amb22000496 [0,1,0,0,0,0|3,0,0]=4 1419 B11R1.24 Fc1cc(ccc1)NCCBr Amb25311264 [0,1,0,0,0,0|1,0,1]=3 1420 B11R1.24 Fc1cc(ccc1)SCCCl Amb25779976 [0,1,0,0,0,0|2,0,1]=4 1421 B11R1.24 Fc1cccc(NCCF)[n]1 Amb24501811 [0,1,0,0,0,0|2,0,1]=4 1422 B11R1.24 Fc1cccc(c1)OCCF Amb22232794 [0,1,0,0,0,0|2,0,1]=4 1423 B11R1.24 N#CCCc1cccc(I)c1 Amb25312666 [0,1,0,0,0,0|2,0,1]=4 1424 B11R1.24 N#CCCc1cccc(c1)C Amb17204296 [0,1,0,0,0,0|2,0,1]=4 1425 B11R1.24 N#CCCc1cccc(c1)Cl Amb17204310 [0,1,0,0,0,0|2,0,1]=4 1426 B11R1.24 N#CCCc1cccc(c1)F Amb10841716 [0,1,0,0,0,0|2,0,1]=4 1427 B11R1.24 N#CCNc1cccc(Br)[n]1 Amb18131354 [0,1,0,0,0,0|2,0,1]=4 1428 B11R1.24 N#CCSc1cccc(Br)c1 Amb20642031 [0,1,0,0,0,0|2,0,1]=4 1429 B11R1.24 N#CCSc1cccc(Cl)c1 Amb18324763 [0,1,0,0,0,0|2,0,1]=4 1430 B11R1.24 N#CCSc1cccc(O)c1 Amb25748990 [0,1,0,0,0,0|2,0,1]=4 1431 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.24 NCCCc1cccc(c1)Cl Amb13951536 [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.24 NCCCc1cccc(c1)F Amb13949159 [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.24 NCCCc1cccc(c1)N Amb17477694 [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.24 NCCCc1cccc(c1)O Amb17101314 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.24 NCCNc1cc(Br)c[n]c1 Amb24440030 [0,1,0,0,0,0|2,0,1]=4 1437 B11R1.24 NCCNc1cc(F)c[n]c1 Amb18999334 [0,1,0,0,0,0|2,0,1]=4 1438 B11R1.24 NCCNc1cccc(F)[n]1 Amb24072626 [0,1,0,0,0,0|2,0,1]=4 1439 B11R1.24 NCCNc1cccc(c1)Br Amb17091074 [0,1,0,0,0,0|1,0,1]=3 1440 B11R1.24 NCCNc1cccc(c1)C Amb17057745 [0,1,0,0,0,0|1,0,1]=3 1441 B11R1.24 NCCNc1cccc(c1)Cl Amb17057750 [0,1,0,0,0,0|1,0,1]=3 1442 B11R1.24 NCCNc1cccc(c1)F Amb17057748 [0,1,0,0,0,0|1,0,1]=3 1443 B11R1.24 NCCOc1cc(O)ccc1 Amb24085157 [0,1,0,0,0,0|2,0,1]=4 1444 B11R1.24 NCCOc1cccc(c1)Br Amb10609758 [0,1,0,0,0,0|2,0,1]=4 1445 B11R1.24 NCCOc1cccc(c1)Br Amb1111484 [0,1,0,0,0,0|2,0,1]=4 1446 B11R1.24 NCCOc1cccc(c1)C Amb1098983 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.24 NCCOc1cccc(c1)Cl Amb1098576 [0,1,0,0,0,0|2,0,1]=4 1448 B11R1.24 NCCOc1cccc(c1)F Amb1126100 [0,1,0,0,0,0|2,0,1]=4 1449 B11R1.24 NCCSc1cc(Br)ccc1 Amb18998111 [0,1,0,0,0,0|2,0,1]=4 1450 B11R1.24 NCCSc1cc(F)ccc1 Amb21861531 [0,1,0,0,0,0|2,0,1]=4 1451 B11R1.24 NCCSc1cccc(c1)C Amb17083043 [0,1,0,0,0,0|2,0,1]=4 1452 B11R1.24 NCCSc1cccc(c1)Cl Amb17083052 [0,1,0,0,0,0|2,0,1]=4 1453 B11R1.24 NNCCc1cccc(Cl)c1 Amb24064170 [0,1,0,0,0,0|3,0,0]=4 1454 B11R1.24 NNCCc1cccc(c1)Br Amb17404394 [0,1,0,0,0,0|3,0,0]=4 1455 B11R1.24 NNCCc1cccc(c1)C Amb17399915 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.24 NNCCc1cccc(c1)Cl Amb17400340 [0,1,0,0,0,0|3,0,0]=4 1457 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|3,0,0]=4 1458 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|3,0,0]=4 1459 B11R1.24 Nc1cc(CCC=O)cc[n]1 Amb25052314 [0,1,0,0,0,0|3,0,0]=4 1460 B11R1.24 Nc1cc(CCC=O)ccc1 Amb24486988 [0,1,0,0,0,0|2,0,0]=3 1461 B11R1.24 Nc1cc(NCC=C)ncc1 Amb17334286 [0,1,0,0,0,0|1,0,0]=2 1462 B11R1.24 Nc1cc(NCCF)[n]cc1 Amb24501789 [0,1,0,0,0,0|2,0,1]=4 1463 B11R1.24 Nc1cc(NCCO)[n]cc1 Amb18981464 [0,1,0,0,0,0|2,0,1]=4 1464 B11R1.24 Nc1cc(c[n]c1)NCCO Amb24347580 [0,1,0,0,0,0|2,0,1]=4 1465 B11R1.24 Nc1cc(ccc1)OCCCl Amb22587140 [0,1,0,0,0,0|2,0,1]=4 1466 B11R1.24 Nc1cc(ccc1)OCCF Amb20669100 [0,1,0,0,0,0|2,0,1]=4 1467 B11R1.24 Nc1cc(ccc1)SCCO Amb18289366 [0,1,0,0,0,0|2,0,1]=4 1468 B11R1.24 Nc1cc[n]c(c1)NCCN Amb18298681 [0,1,0,0,0,0|2,0,1]=4 1469 B11R1.24 Nc1cccc(NCCCl)[n]1 Amb25060780 [0,1,0,0,0,0|2,0,1]=4 1470 B11R1.24 Nc1cccc(NCCO)[n]1 Amb25771408 [0,1,0,0,0,0|2,0,1]=4 1471 B11R1.24 Nc1cccc(c1)NCCN Amb18991498 [0,1,0,0,0,0|1,0,1]=3 1472 B11R1.24 Nc1cccc(c1)OCCN Amb18251365 [0,1,0,0,0,0|2,0,1]=4 1473 B11R1.24 Nc1cccc(c1)SCCN Amb25149157 [0,1,0,0,0,0|2,0,1]=4 1474 B11R1.24 O=CC#Cc1cc(F)ccc1 Amb18117776 [0,1,0,0,0,0|2,0,1]=4 1475 B11R1.24 O=CCCc1cc[n]c(Cl)c1 Amb24619570 [0,1,0,0,0,0|3,0,0]=4 1476 B11R1.24 O=CCCc1cccc(Cl)[n]1 Amb24511743 [0,1,0,0,0,0|3,0,0]=4 1477 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|2,0,0]=3 1478 B11R1.24 O=CCCc1cccc(S)c1 Amb24615973 [0,1,0,0,0,0|2,0,0]=3 1479 B11R1.24 O=CCCc1cccc(c1)Br Amb17081695 [0,1,0,0,0,0|2,0,0]=3 1480 B11R1.24 O=CCCc1cccc(c1)O Amb17081694 [0,1,0,0,0,0|2,0,0]=3 1481 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|2,0,0]=3 1482 B11R1.24 O=CCOc1cccc(F)c1 Amb18182893 [0,1,0,0,0,0|2,0,0]=3 1483 B11R1.24 O=CCOc1cccc(c1)Br Amb17099951 [0,1,0,0,0,0|2,0,0]=3 1484 B11R1.24 O=CCSc1cccc(c1)C Amb17082932 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.24 O=CCSc1cccc(c1)Cl Amb17082942 [0,1,0,0,0,0|2,0,0]=3 1486 B11R1.24 O=CNCc1cccc(Cl)c1 Amb24544518 [0,1,0,0,0,0|3,0,0]=4 1487 B11R1.24 O=CNCc1cccc(F)c1 Amb19958743 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.24 O=CNNc1cccc(Br)[n]1 Amb22261494 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.24 O=C\C=C\c1cccc(c1)Br Amb17240826 [0,1,0,0,0,0|2,0,1]=4 1490 B11R1.24 O=C\C=C\c1cccc(c1)C Amb17232008 [0,1,0,0,0,0|2,0,1]=4 1491 B11R1.24 O=C\C=C\c1cccc(c1)Cl Amb16193215 [0,1,0,0,0,0|2,0,1]=4 1492 B11R1.24 O=C\C=C\c1cccc(c1)F Amb17232063 [0,1,0,0,0,0|2,0,1]=4 1493 B11R1.24 O=C\C=C\c1cccc(c1)O Amb17334281 [0,1,0,0,0,0|2,0,1]=4 1494 B11R1.24 OCCCc1cccc(I)c1 Amb25075756 [0,1,0,0,0,0|2,0,1]=4 1495 B11R1.24 OCCCc1cccc(c1)Br Amb17089515 [0,1,0,0,0,0|2,0,1]=4 1496 B11R1.24 OCCCc1cccc(c1)C Amb17089495 [0,1,0,0,0,0|2,0,1]=4 1497 B11R1.24 OCCCc1cccc(c1)Cl Amb17089500 [0,1,0,0,0,0|2,0,1]=4 1498 B11R1.24 OCCCc1cccc(c1)F Amb17605781 [0,1,0,0,0,0|2,0,1]=4 1499 B11R1.24 OCCCc1cccc(c1)N Amb17477701 [0,1,0,0,0,0|2,0,1]=4 1500 B11R1.24 OCCCc1cccc(c1)O Amb17089514 [0,1,0,0,0,0|2,0,1]=4 1501 B11R1.24 OCCNc1cc(Br)c[n]c1 Amb23744553 [0,1,0,0,0,0|2,0,1]=4 1502 B11R1.24 OCCNc1cc(Br)cc[n]1 Amb24429841 [0,1,0,0,0,0|2,0,1]=4 1503 B11R1.24 OCCNc1cc(Cl)cc[n]1 Amb25191172 [0,1,0,0,0,0|2,0,1]=4 1504 B11R1.24 OCCNc1cccc(Cl)[n]1 Amb21958722 [0,1,0,0,0,0|2,0,1]=4 1505 B11R1.24 OCCNc1cccc(F)[n]1 Amb18973531 [0,1,0,0,0,0|2,0,1]=4 1506 B11R1.24 OCCOc1cccc(c1)C Amb2209346 [0,1,0,0,0,0|2,0,1]=4 1507 B11R1.24 OCCSc1cc(Br)ccc1 Amb21861665 [0,1,0,0,0,0|2,0,1]=4 1508 B11R1.24 Oc1cc(CCCBr)ccc1 Amb18657769 [0,1,0,0,0,0|2,0,1]=4 1509 B11R1.24 Oc1cc(CNC=O)ccc1 Amb18179387 [0,1,0,0,0,0|3,0,0]=4 1510 B11R1.24 Oc1cc(ccc1)C#CC=O Amb18635848 [0,1,0,0,0,0|2,0,1]=4 1511 B11R1.24 Oc1cc(ccc1)OCCF Amb24484451 [0,1,0,0,0,0|2,0,1]=4 1512 B11R1.24 Oc1cc(ccc1)SCCF Amb24486779 [0,1,0,0,0,0|2,0,1]=4 1513 B11R1.24 SCCCc1cccc(c1)Br Amb17407561 [0,1,0,0,0,0|2,0,1]=4 1514 B11R1.24 SCCCc1cccc(c1)C Amb17400219 [0,1,0,0,0,0|2,0,1]=4 1515 B11R1.24 SCCCc1cccc(c1)Cl Amb17401096 [0,1,0,0,0,0|2,0,1]=4 1516 B11R1.24 SCCOc1cc(I)ccc1 Amb25189185 [0,1,0,0,0,0|2,0,1]=4 1517 B11R1.24 SCCOc1cccc(c1)C Amb17232680 [0,1,0,0,0,0|2,0,1]=4 1518 B11R1.24 SCCOc1cccc(c1)F Amb17232867 [0,1,0,0,0,0|2,0,1]=4 1519 B11R1.24 SCCOc1cccc(c1)N Amb17504035 [0,1,0,0,0,0|2,0,1]=4 1520 B11R1.24 SCCSc1cc(Br)ccc1 Amb25058330 [0,1,0,0,0,0|2,0,1]=4 1521 B11R1.24 [NH3+]c1cc(ccc1)OCCF Amb22455032 [0,1,0,0,0,0|2,0,1]=4 1522 B11R1.28 BrCC=C=Cc1ccccc1 Amb24624052 [0,1,0,0,0,0|1,0,2]=4 1523 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|1,0,2]=4 1524 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|1,0,1]=3 1525 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|2,0,1]=4 1526 B11R1.28 BrCC\N=C\c1ccccc1 Amb25076253 [0,1,0,0,0,0|1,0,2]=4 1527 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [0,1,0,0,0,0|1,0,2]=4 1528 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [0,1,0,0,0,0|2,0,1]=4 1529 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [0,1,0,0,0,0|0,0,0]=1 1530 B11R1.28 C#CCC#Cc1ccccc1 Amb16233222 [0,1,0,0,0,0|1,0,2]=4 1531 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|1,0,2]=4 1532 B11R1.28 C#CCCNc1cccc[n]1 Amb25189260 [0,1,0,0,0,0|1,0,2]=4 1533 B11R1.28 C#CCCNc1ccccc1 Amb25063678 [0,1,0,0,0,0|0,0,2]=3 1534 B11R1.28 C#CCCSc1ccccc1 Amb24477610 [0,1,0,0,0,0|1,0,2]=4 1535 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|0,0,2]=3 1536 B11R1.28 C#CCONc1cc[n]cc1 Amb25680343 [0,1,0,0,0,0|1,0,2]=4 1537 B11R1.28 C#CCONc1cccc[n]1 Amb24370983 [0,1,0,0,0,0|1,0,2]=4 1538 B11R1.28 C#CCSCc1ccccc1 Amb18800670 [0,1,0,0,0,0|1,0,2]=4 1539 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|0,0,3]=4 1540 B11R1.28 C/C=C/C=C/c1ccccc1 Amb17939507 [0,1,0,0,0,0|1,0,1]=3 1541 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|1,0,0]=2 1542 B11R1.28 C=C=CC#Cc1ccccc1 Amb24085507 [0,1,0,0,0,0|1,0,1]=3 1543 B11R1.28 C=CCC#Cc1c[n]ccc1 Amb24085282 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|1,0,0]=2 1545 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [0,1,0,0,0,0|1,0,0]=2 1546 B11R1.28 C=CCCNc1[n]ccc[n]1 Amb24464342 [0,1,0,0,0,0|2,0,0]=3 1547 B11R1.28 C=CCCNc1c[n]cc[n]1 Amb24734564 [0,1,0,0,0,0|2,0,0]=3 1548 B11R1.28 C=CCCNc1cc[n]cc1 Amb25853434 [0,1,0,0,0,0|1,0,0]=2 1549 B11R1.28 C=CCCOc1[n]ccc[n]1 Amb24100507 [0,1,0,0,0,0|3,0,0]=4 1550 B11R1.28 C=CCCOc1c[n]ccc1 Amb24085225 [0,1,0,0,0,0|2,0,0]=3 1551 B11R1.28 C=CCCOc1cc[n]cc1 Amb24750926 [0,1,0,0,0,0|2,0,0]=3 1552 B11R1.28 C=CCNCc1[n]ccc[n]1 Amb19028625 [0,1,0,0,0,0|2,0,0]=3 1553 B11R1.28 C=CCNCc1c[n]c[n]c1 Amb19029394 [0,1,0,0,0,0|2,0,0]=3 1554 B11R1.28 C=CCNCc1c[n]cc[n]1 Amb18314215 [0,1,0,0,0,0|2,0,0]=3 1555 B11R1.28 C=CCNCc1c[n]ccc1 Amb19890377 [0,1,0,0,0,0|1,0,0]=2 1556 B11R1.28 C=CCNCc1c[n]ccc1 Amb19891174 [0,1,0,0,0,0|1,0,0]=2 1557 B11R1.28 C=CCNCc1cc[n]c[n]1 Amb19030311 [0,1,0,0,0,0|2,0,0]=3 1558 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890311 [0,1,0,0,0,0|1,0,0]=2 1559 B11R1.28 C=CCNCc1cc[n]cc1 Amb19890811 [0,1,0,0,0,0|1,0,0]=2 1560 B11R1.28 C=CCNCc1cccc[n]1 Amb19890291 [0,1,0,0,0,0|1,0,0]=2 1561 B11R1.28 C=CCNCc1cccc[n]1 Amb19891173 [0,1,0,0,0,0|1,0,0]=2 1562 B11R1.28 C=CCOCc1cc[n]cc1 Amb24103231 [0,1,0,0,0,0|2,0,0]=3 1563 B11R1.28 C=CCOCc1cccc[n]1 Amb24106728 [0,1,0,0,0,0|2,0,0]=3 1564 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|1,0,0]=2 1565 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [0,1,0,0,0,0|1,0,0]=2 1566 B11R1.28 C=CC\C=N\c1ccccc1 Amb10574759 [0,1,0,0,0,0|0,0,1]=2 1567 B11R1.28 C=CC\N=C/c1cccc[n]1 Amb25108524 [0,1,0,0,0,0|1,0,1]=3 1568 B11R1.28 C=CC\N=C/c1ccccc1 Amb24108502 [0,1,0,0,0,0|0,0,1]=2 1569 B11R1.28 C=CC\N=C\c1cc[n]cc1 Amb24705579 [0,1,0,0,0,0|1,0,1]=3 1570 B11R1.28 C=CC\N=C\c1cccc[n]1 Amb24598681 [0,1,0,0,0,0|1,0,1]=3 1571 B11R1.28 C=C\C=N\Nc1ccccc1 Amb24649776 [0,1,0,0,0,0|0,0,1]=2 1572 B11R1.28 C=NCCNc1ccccc1 Amb24486057 [0,1,0,0,0,0|0,0,1]=2 1573 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [0,1,0,0,0,0|0,0,2]=3 1574 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|1,0,2]=4 1575 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [0,1,0,0,0,0|2,0,0]=3 1576 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [0,1,0,0,0,0|1,0,0]=2 1577 B11R1.28 CCCNCc1c[n]ccc1 Amb19890575 [0,1,0,0,0,0|1,0,2]=4 1578 B11R1.28 CCCNCc1cc[n]cc1 Amb19890591 [0,1,0,0,0,0|1,0,2]=4 1579 B11R1.28 CCCNCc1cccc[n]1 Amb19890306 [0,1,0,0,0,0|1,0,2]=4 1580 B11R1.28 CCCNCc1cccc[n]1 Amb19890563 [0,1,0,0,0,0|1,0,2]=4 1581 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|0,0,2]=3 1582 B11R1.28 CCCSSc1ccccc1 Amb25383743 [0,1,0,0,0,0|1,0,2]=4 1583 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|0,0,3]=4 1584 B11R1.28 CCNCCc1ccccc1 Amb2119468 [0,1,0,0,0,0|1,0,2]=4 1585 B11R1.28 CCOCNc1ccccc1 Amb25856976 [0,1,0,0,0,0|0,0,2]=3 1586 B11R1.28 CCOCSc1ccccc1 Amb24762591 [0,1,0,0,0,0|1,0,2]=4 1587 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|1,0,2]=4 1588 B11R1.28 CCSCSc1ccccc1 Amb25380606 [0,1,0,0,0,0|1,0,2]=4 1589 B11R1.28 CC\N=C\Nc1ccccc1 Amb24384245 [0,1,0,0,0,0|0,0,3]=4 1590 B11R1.28 CNCC#Cc1ccccc1 Amb18296119 [0,1,0,0,0,0|2,0,1]=4 1591 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|1,0,2]=4 1592 B11R1.28 CNCCNc1cc[n]cc1 Amb18313323 [0,1,0,0,0,0|1,0,2]=4 1593 B11R1.28 CNCCNc1cccc[n]1 Amb18313466 [0,1,0,0,0,0|1,0,2]=4 1594 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|1,0,2]=4 1595 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|1,0,2]=4 1596 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|1,0,2]=4 1597 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|2,0,1]=4 1598 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|2,0,1]=4 1599 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [0,1,0,0,0,0|1,0,2]=4 1600 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|1,0,1]=3 1601 B11R1.28 CONCCc1ccccc1 Amb22897018 [0,1,0,0,0,0|2,0,1]=4 1602 B11R1.28 CONCOc1ccccc1 Amb24096695 [0,1,0,0,0,0|2,0,1]=4 1603 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|1,0,2]=4 1604 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [0,1,0,0,0,0|1,0,2]=4 1605 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|1,0,2]=4 1606 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|0,0,2]=3 1607 B11R1.28 CSCSCc1ccccc1 Amb25380610 [0,1,0,0,0,0|2,0,1]=4 1608 B11R1.28 C\C=C/CNc1[n]ccc[n]1 Amb25723733 [0,1,0,0,0,0|2,0,0]=3 1609 B11R1.28 C\C=C/N=C/c1c[n]ccc1 Amb24486027 [0,1,0,0,0,0|3,0,0]=4 1610 B11R1.28 C\C=C/N=C\c1cc[n]cc1 Amb25793611 [0,1,0,0,0,0|3,0,0]=4 1611 B11R1.28 C\C=C\C=C\c1cccc[n]1 Amb24101888 [0,1,0,0,0,0|2,0,1]=4 1612 B11R1.28 C\C=C\C=Cc1cccc[n]1 Amb25681413 [0,1,0,0,0,0|2,0,1]=4 1613 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [0,1,0,0,0,0|2,0,0]=3 1614 B11R1.28 C\C=C\CNc1c[n]ccc1 Amb25228933 [0,1,0,0,0,0|1,0,0]=2 1615 B11R1.28 C\C=C\COc1c[n]ccc1 Amb25151771 [0,1,0,0,0,0|2,0,0]=3 1616 B11R1.28 C\C=C\COc1cccc[n]1 Amb24101955 [0,1,0,0,0,0|2,0,0]=3 1617 B11R1.28 C\C=C\CSc1[n]ccc[n]1 Amb25051172 [0,1,0,0,0,0|3,0,0]=4 1618 B11R1.28 C\C=C\CSc1c[n]cc[n]1 Amb24588011 [0,1,0,0,0,0|3,0,0]=4 1619 B11R1.28 C\C=C\N=Cc1c[n]ccc1 Amb24518405 [0,1,0,0,0,0|3,0,0]=4 1620 B11R1.28 C\C=C\N=Cc1cc[n]cc1 Amb24518438 [0,1,0,0,0,0|3,0,0]=4 1621 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [0,1,0,0,0,0|2,0,1]=4 1622 B11R1.28 ClC=C=C=Cc1ccccc1 Amb25108683 [0,1,0,0,0,0|1,0,2]=4 1623 B11R1.28 ClCCC#Cc1ccccc1 Amb18792613 [0,1,0,0,0,0|2,0,1]=4 1624 B11R1.28 ClCCCNc1cc[n]cc1 Amb25246119 [0,1,0,0,0,0|1,0,2]=4 1625 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|1,0,2]=4 1626 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|1,0,2]=4 1627 B11R1.28 ClCCNCc1ccccn1 Amb17334832 [0,1,0,0,0,0|2,0,1]=4 1628 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [0,1,0,0,0,0|2,0,1]=4 1629 B11R1.28 ClCCNCc1ccncc1 Amb17334834 [0,1,0,0,0,0|2,0,1]=4 1630 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|2,0,1]=4 1631 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [0,1,0,0,0,0|1,0,2]=4 1632 B11R1.28 ClC\C=C\Oc1ccccc1 Amb24548862 [0,1,0,0,0,0|1,0,2]=4 1633 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [0,1,0,0,0,0|2,0,1]=4 1634 B11R1.28 Cl[Zn]C\C=C\c1ccccc1 Amb22897734 [0,1,0,0,0,0|3,0,0]=4 1635 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [0,1,0,0,0,0|0,0,0]=1 1636 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [0,1,0,0,0,0|0,0,0]=1 1637 B11R1.28 Cl\C=C\COc1c[n]ccc1 Amb25733978 [0,1,0,0,0,0|2,0,0]=3 1638 B11R1.28 Cl\C=C\CSc1[n]ccc[n]1 Amb24749452 [0,1,0,0,0,0|3,0,0]=4 1639 B11R1.28 Cl\C=C\CSc1c[n]cc[n]1 Amb24676317 [0,1,0,0,0,0|3,0,0]=4 1640 B11R1.28 FCCCOc1ccccc1 Amb22008296 [0,1,0,0,0,0|1,0,2]=4 1641 B11R1.28 FCCCSc1ccccc1 Amb25382654 [0,1,0,0,0,0|1,0,2]=4 1642 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|1,0,1]=3 1643 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|1,0,2]=4 1644 B11R1.28 ICCNCc1ccccc1 Amb25188796 [0,1,0,0,0,0|1,0,1]=3 1645 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|2,0,1]=4 1646 B11R1.28 N#CCC#Cc1ccccc1 Amb25705489 [0,1,0,0,0,0|2,0,1]=4 1647 B11R1.28 N#CCCNc1c[n]ccc1 Amb24085246 [0,1,0,0,0,0|1,0,2]=4 1648 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|0,0,2]=3 1649 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|1,0,2]=4 1650 B11R1.28 N#CCNCc1ccccc1 Amb22491357 [0,1,0,0,0,0|1,0,1]=3 1651 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|1,0,2]=4 1652 B11R1.28 N#C\C=C\Nc1ccccc1 Amb18124676 [0,1,0,0,0,0|0,0,2]=3 1653 B11R1.28 N#C\C=N\Nc1cccc[n]1 Amb25189456 [0,1,0,0,0,0|2,0,1]=4 1654 B11R1.28 N#C\C=N\Nc1ccccc1 Amb24504734 [0,1,0,0,0,0|1,0,1]=3 1655 B11R1.28 N=N=NCSc1ccccc1 Amb22360722 [0,1,0,0,0,0|3,0,0]=4 1656 B11R1.28 NCCC#Cc1ccccc1 Amb18993041 [0,1,0,0,0,0|2,0,1]=4 1657 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|1,0,2]=4 1658 B11R1.28 NCCCCc1ccccc1 Amb19929939 [0,1,0,0,0,0|1,0,2]=4 1659 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|0,0,2]=3 1660 B11R1.28 NCCCNc1cccnc1 Amb10607841 [0,1,0,0,0,0|1,0,2]=4 1661 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|1,0,2]=4 1662 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|1,0,2]=4 1663 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|1,0,2]=4 1664 B11R1.28 NCCNCc1ccccn1 Amb17091028 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.28 NCCNCc1cccnc1 Amb17091029 [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.28 NCCNCc1ccncc1 Amb17091030 [0,1,0,0,0,0|2,0,1]=4 1667 B11R1.28 NCCNNc1ccccc1 Amb24763429 [0,1,0,0,0,0|1,0,1]=3 1668 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|2,0,1]=4 1669 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|2,0,1]=4 1671 B11R1.28 NCNCCc1ccccc1 Amb25385258 [0,1,0,0,0,0|2,0,1]=4 1672 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [0,1,0,0,0,0|1,0,2]=4 1673 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|2,0,1]=4 1674 B11R1.28 NNCCSc1ccccc1 Amb18126564 [0,1,0,0,0,0|2,0,1]=4 1675 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.28 NNNCNc1ccccc1 Amb25251558 [0,1,0,0,0,0|2,0,0]=3 1677 B11R1.28 NOCCCc1ccccc1 Amb22231356 [0,1,0,0,0,0|2,0,1]=4 1678 B11R1.28 NOCCNc1ccccc1 Amb24486573 [0,1,0,0,0,0|1,0,1]=3 1679 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|2,0,1]=4 1680 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|2,0,1]=4 1681 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|3,0,0]=4 1682 B11R1.28 NOC\C=C\c1ccccc1 Amb18124997 [0,1,0,0,0,0|3,0,0]=4 1683 B11R1.28 N\C=C/C=C\c1cc[n]cc1 Amb24577176 [0,1,0,0,0,0|2,0,1]=4 1684 B11R1.28 N\C=C\C=Cc1cc[n]cc1 Amb25254887 [0,1,0,0,0,0|2,0,1]=4 1685 B11R1.28 N\C=C\C=Cc1ccccc1 Amb24628941 [0,1,0,0,0,0|1,0,1]=3 1686 B11R1.28 N\C=C\C=Nc1ccccc1 Amb24697696 [0,1,0,0,0,0|0,0,2]=3 1687 B11R1.28 N\C=N\N=Cc1ccccc1 Amb24655535 [0,1,0,0,0,0|2,0,1]=4 1688 B11R1.28 O=C=C=CNc1ccccc1 Amb24434760 [0,1,0,0,0,0|0,0,3]=4 1689 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|2,0,1]=4 1690 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|2,0,1]=4 1691 B11R1.28 O=CC#CCc1ccccc1 Amb25189233 [0,1,0,0,0,0|1,0,2]=4 1692 B11R1.28 O=CC=C=Cc1ccccc1 Amb24435266 [0,1,0,0,0,0|1,0,1]=3 1693 B11R1.28 O=CC=NNc1ccccc1 Amb24060829 [0,1,0,0,0,0|1,0,0]=2 1694 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [0,1,0,0,0,0|2,0,1]=4 1695 B11R1.28 O=CCCCc1cc[n]cc1 Amb24099515 [0,1,0,0,0,0|2,0,1]=4 1696 B11R1.28 O=CCCCc1cccc[n]1 Amb22897023 [0,1,0,0,0,0|2,0,1]=4 1697 B11R1.28 O=CCCOc1cccc[n]1 Amb24762999 [0,1,0,0,0,0|2,0,1]=4 1698 B11R1.28 O=CCCSc1cccc[n]1 Amb18177861 [0,1,0,0,0,0|2,0,1]=4 1699 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|1,0,1]=3 1700 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|1,0,0]=2 1701 B11R1.28 O=CCONc1ccccc1 Amb24434643 [0,1,0,0,0,0|1,0,0]=2 1702 B11R1.28 O=CCSCc1cc[n]cc1 Amb25383559 [0,1,0,0,0,0|3,0,0]=4 1703 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|2,0,0]=3 1704 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [0,1,0,0,0,0|2,0,0]=3 1705 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [0,1,0,0,0,0|3,0,0]=4 1706 B11R1.28 O=CNCCc1cc[n]cc1 Amb24371433 [0,1,0,0,0,0|3,0,0]=4 1707 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [0,1,0,0,0,0|2,0,0]=3 1708 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [0,1,0,0,0,0|2,0,0]=3 1709 B11R1.28 O=CN\C=C\c1ccccc1 Amb25327993 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.28 O=C\C=C/Sc1ccccc1 Amb25827121 [0,1,0,0,0,0|1,0,1]=3 1711 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [0,1,0,0,0,0|1,0,1]=3 1712 B11R1.28 O=C\C=C\Nc1cc[n]cc1 Amb25145907 [0,1,0,0,0,0|1,0,1]=3 1713 B11R1.28 O=C\C=C\Nc1cccc[n]1 Amb18124899 [0,1,0,0,0,0|1,0,1]=3 1714 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [0,1,0,0,0,0|0,0,1]=2 1715 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,0|1,0,1]=3 1716 B11R1.28 O=C\C=C\Sc1ccccc1 Amb10563475 [0,1,0,0,0,0|1,0,1]=3 1717 B11R1.28 O=C\C=N/Nc1ccccc1 Amb24638012 [0,1,0,0,0,0|1,0,0]=2 1718 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,0,0,0,0|1,0,0]=2 1719 B11R1.28 OCC=C=Cc1ccccc1 Amb24398063 [0,1,0,0,0,0|1,0,2]=4 1720 B11R1.28 OCCCNc1c[n]ccc1 Amb18267758 [0,1,0,0,0,0|1,0,2]=4 1721 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|0,0,2]=3 1722 B11R1.28 OCCCNc1ccccc1 Amb17772314 [0,1,0,0,0,0|0,0,2]=3 1723 B11R1.28 OCCN=Cc1ccccc1 Amb24065097 [0,1,0,0,0,0|1,0,2]=4 1724 B11R1.28 OCCNCc1cccc[n]1 Amb21955286 [0,1,0,0,0,0|2,0,1]=4 1725 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|1,0,1]=3 1726 B11R1.28 OCC\C=C\c1ccccc1 Amb24756581 [0,1,0,0,0,0|2,0,1]=4 1727 B11R1.28 OCC\N=C\c1ccccc1 Amb20622247 [0,1,0,0,0,0|1,0,2]=4 1728 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [0,1,0,0,0,0|1,0,2]=4 1729 B11R1.28 OC\C=C\Nc1ccccc1 Amb25228349 [0,1,0,0,0,0|0,0,2]=3 1730 B11R1.28 OC\C=C\Oc1ccccc1 Amb25283274 [0,1,0,0,0,0|1,0,2]=4 1731 B11R1.28 OC\C=N\Nc1ccccc1 Amb25801902 [0,1,0,0,0,0|1,0,1]=3 1732 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|2,0,1]=4 1733 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|2,0,1]=4 1734 B11R1.28 O\N=C\CNc1ccccc1 Amb25211715 [0,1,0,0,0,0|1,0,0]=2 1735 B11R1.28 O\N=C\N=N\c1ccccc1 Amb2228038 [0,1,0,0,0,0|2,0,1]=4 1736 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|1,0,2]=4 1737 B11R1.28 SCCCNc1c[n]ccc1 Amb25059157 [0,1,0,0,0,0|1,0,2]=4 1738 B11R1.28 SCC\C=C\c1ccccc1 Amb24390438 [0,1,0,0,0,0|2,0,1]=4 1739 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|3,0,0]=4 1740 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|3,0,0]=4 1741 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [0,1,0,0,0,0|1,0,2]=4 1742 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [0,1,0,0,0,0|2,0,1]=4 1743 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,1,0,0,0,0|2,0,1]=4 1744 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|1,0,2]=4 1745 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,1,0,0,0,0|2,0,1]=4 1746 B11R1.40 BrCC(Oc1ccccc1)C Amb17241866 [0,1,0,0,0,0|2,0,1]=4 1747 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,1,0,0,0,0|0,0,3]=4 1748 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,1,0,0,0,0|1,0,2]=4 1749 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,1,0,0,0,0|1,0,2]=4 1750 B11R1.40 C#CC(O)Nc1ccccc1 Amb24561876 [0,1,0,0,0,0|0,0,2]=3 1751 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,1,0,0,0,0|1,0,2]=4 1752 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [0,1,0,0,0,0|0,0,1]=2 1753 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [0,1,0,0,0,0|2,0,1]=4 1754 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [0,1,0,0,0,0|2,0,1]=4 1755 B11R1.40 C=CC(=O)Cc1cccc[n]1 Amb24425169 [0,1,0,0,0,0|2,0,1]=4 1756 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|1,0,1]=3 1757 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [0,1,0,0,0,0|1,0,1]=3 1758 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [0,1,0,0,0,0|1,0,0]=2 1759 B11R1.40 C=CC(N)Cc1cccc[n]1 Amb25077646 [0,1,0,0,0,0|2,0,0]=3 1760 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,1,0,0,0,0|1,0,0]=2 1761 B11R1.40 C=CC(O)Cc1c[n]ccc1 Amb25097959 [0,1,0,0,0,0|2,0,0]=3 1762 B11R1.40 C=CC(O)Cc1cccc[n]1 Amb25241001 [0,1,0,0,0,0|2,0,0]=3 1763 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|1,0,0]=2 1764 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,1,0,0,0,0|1,0,0]=2 1765 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,1,0,0,0,0|1,0,0]=2 1766 B11R1.40 C=C[C@H](O)Cc1cccc[n]1 Amb25806691 [0,1,0,0,0,0|2,0,0]=3 1767 B11R1.40 CC(C#N)Nc1c[n]ccc1 Amb24100579 [0,1,0,0,0,0|2,0,1]=4 1768 B11R1.40 CC(C#N)Nc1cccc[n]1 Amb18644336 [0,1,0,0,0,0|2,0,1]=4 1769 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,1,0,0,0,0|2,0,1]=4 1770 B11R1.40 CC(C=C)Nc1[n]ccc[n]1 Amb24463444 [0,1,0,0,0,0|2,0,0]=3 1771 B11R1.40 CC(C=C)Nc1cc[n]cc1 Amb24360653 [0,1,0,0,0,0|1,0,0]=2 1772 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|0,0,0]=1 1773 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [0,1,0,0,0,0|1,0,0]=2 1774 B11R1.40 CC(C=C)Sc1[n]ccc[n]1 Amb25163100 [0,1,0,0,0,0|3,0,0]=4 1775 B11R1.40 CC(C=C)Sc1c[n]cc[n]1 Amb25032971 [0,1,0,0,0,0|3,0,0]=4 1776 B11R1.40 CC(C=C)Sc1ccc[n][n]1 Amb24556813 [0,1,0,0,0,0|3,0,0]=4 1777 B11R1.40 CC(C=C)Sc1cccc[n]1 Amb24404468 [0,1,0,0,0,0|2,0,0]=3 1778 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [0,1,0,0,0,0|1,0,0]=2 1779 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|2,0,0]=3 1780 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|2,0,0]=3 1781 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,1]=4 1782 B11R1.40 CC(CCl)Nc1cc[n]cc1 Amb24420964 [0,1,0,0,0,0|2,0,1]=4 1783 B11R1.40 CC(CCl)Sc1ccccc1 Amb25772834 [0,1,0,0,0,0|2,0,1]=4 1784 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|2,0,1]=4 1785 B11R1.40 CC(CN)Nc1cc[n]cc1 Amb18908422 [0,1,0,0,0,0|2,0,1]=4 1786 B11R1.40 CC(CN)Nc1cccc[n]1 Amb24477483 [0,1,0,0,0,0|2,0,1]=4 1787 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,1,0,0,0,0|1,0,1]=3 1788 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|1,0,1]=3 1789 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,1,0,0,0,0|2,0,1]=4 1790 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,1,0,0,0,0|2,0,1]=4 1791 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,1,0,0,0,0|1,0,0]=2 1792 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,1,0,0,0,0|3,0,0]=4 1793 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,1,0,0,0,0|3,0,0]=4 1794 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,1,0,0,0,0|3,0,0]=4 1795 B11R1.40 CC(Nc1ccccc1)C#N Amb17399903 [0,1,0,0,0,0|1,0,1]=3 1796 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [0,1,0,0,0,0|0,0,3]=4 1797 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|1,0,2]=4 1798 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,1,0,0,0,0|1,0,2]=4 1799 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,1,0,0,0,0|1,0,2]=4 1800 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|1,0,2]=4 1801 B11R1.40 CCS(=O)Nc1ccccc1 Amb24752666 [0,1,0,0,0,0|1,0,2]=4 1802 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,1,0,0,0,0|1,0,2]=4 1803 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,1,0,0,0,0|1,0,2]=4 1804 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,1,0,0,0,0|1,0,2]=4 1805 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|1,0,2]=4 1806 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|1,0,2]=4 1807 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,1,0,0,0,0|1,0,2]=4 1808 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|1,0,2]=4 1809 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,1,0,0,0,0|3,0,0]=4 1810 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,1,0,0,0,0|2,0,1]=4 1811 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,1,0,0,0,0|2,0,1]=4 1812 B11R1.40 COC(=N)Nc1ccccc1 Amb24509579 [0,1,0,0,0,0|1,0,2]=4 1813 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,1,0,0,0,0|1,0,2]=4 1814 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,1,0,0,0,0|2,0,1]=4 1815 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,1,0,0,0,0|2,0,1]=4 1816 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [0,1,0,0,0,0|1,0,0]=2 1817 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|2,0,0]=3 1818 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|2,0,1]=4 1819 B11R1.40 C[C@@H](CO)Nc1cccc[n]1 Amb25205329 [0,1,0,0,0,0|2,0,1]=4 1820 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,1,0,0,0,0|2,0,1]=4 1821 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [0,1,0,0,0,0|3,0,0]=4 1822 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|2,0,1]=4 1823 B11R1.40 C[C@H](CO)Nc1cccc[n]1 Amb25275075 [0,1,0,0,0,0|2,0,1]=4 1824 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,1,0,0,0,0|2,0,0]=3 1825 B11R1.40 C\C(=C/Cl)\Sc1ccccc1 Amb24694004 [0,1,0,0,0,0|2,0,1]=4 1826 B11R1.40 C\C(=C/c1cc[n]cc1)\C=C Amb24103157 [0,1,0,0,0,0|2,0,1]=4 1827 B11R1.40 C\C(=C/c1ccc[n]c1)\C=C Amb24085616 [0,1,0,0,0,0|2,0,1]=4 1828 B11R1.40 C\C(=C/c1cccc[n]1)\C=C Amb24101881 [0,1,0,0,0,0|2,0,1]=4 1829 B11R1.40 C\C(=C\c1cc[n]cc1)\C=C Amb24103181 [0,1,0,0,0,0|2,0,1]=4 1830 B11R1.40 C\C(=C\c1ccc[n]c1)\C=C Amb24085626 [0,1,0,0,0,0|2,0,1]=4 1831 B11R1.40 C\C(=C\c1cccc[n]1)\C=C Amb24101910 [0,1,0,0,0,0|2,0,1]=4 1832 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [0,1,0,0,0,0|2,0,1]=4 1833 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,1,0,0,0,0|2,0,1]=4 1834 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,1,0,0,0,0|2,0,1]=4 1835 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,1,0,0,0,0|2,0,1]=4 1836 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,1,0,0,0,0|2,0,1]=4 1837 B11R1.40 ClCC(Cl)Oc1ccccc1 Amb24358073 [0,1,0,0,0,0|2,0,1]=4 1838 B11R1.40 ClCC(Cl)Sc1ccccc1 Amb24653564 [0,1,0,0,0,0|2,0,1]=4 1839 B11R1.40 ClCC(Oc1ccccc1)C Amb17232796 [0,1,0,0,0,0|2,0,1]=4 1840 B11R1.40 FC(CCl)Sc1ccccc1 Amb24390863 [0,1,0,0,0,0|2,0,1]=4 1841 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,1,0,0,0,0|2,0,1]=4 1842 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,1,0,0,0,0|2,0,1]=4 1843 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,1]=4 1844 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,1,0,0,0,0|2,0,1]=4 1845 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,1,0,0,0,0|2,0,1]=4 1846 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,1,0,0,0,0|2,0,1]=4 1847 B11R1.40 N=C(CS)Nc1ccccc1 Amb25194642 [0,1,0,0,0,0|1,0,2]=4 1848 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,1,0,0,0,0|2,0,1]=4 1849 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,1,0,0,0,0|2,0,1]=4 1850 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,1,0,0,0,0|3,0,0]=4 1851 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [0,1,0,0,0,0|2,0,1]=4 1852 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,1,0,0,0,0|1,0,2]=4 1853 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,1,0,0,0,0|1,0,2]=4 1854 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,1,0,0,0,0|1,0,2]=4 1855 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,1,0,0,0,0|2,0,1]=4 1856 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,1,0,0,0,0|2,0,1]=4 1857 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,1,0,0,0,0|2,0,1]=4 1858 B11R1.40 NCC(Sc1ccccc1)C Amb17485971 [0,1,0,0,0,0|2,0,1]=4 1859 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,1,0,0,0,0|2,0,1]=4 1860 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|2,0,1]=4 1861 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,1,0,0,0,0|2,0,1]=4 1862 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|2,0,1]=4 1863 B11R1.40 NNC(=N)Nc1ccccc1 Amb22459345 [0,1,0,0,0,0|2,0,1]=4 1864 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,1,0,0,0,0|2,0,1]=4 1865 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [0,1,0,0,0,0|2,0,1]=4 1866 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,1,0,0,0,0|2,0,1]=4 1867 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,1,0,0,0,0|2,0,1]=4 1868 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,1,0,0,0,0|2,0,1]=4 1869 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,1,0,0,0,0|2,0,1]=4 1870 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,1,0,0,0,0|2,0,1]=4 1871 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,1,0,0,0,0|2,0,1]=4 1872 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,1,0,0,0,0|2,0,1]=4 1873 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,1,0,0,0,0|2,0,1]=4 1874 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,1,0,0,0,0|2,0,1]=4 1875 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,1,0,0,0,0|2,0,0]=3 1876 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,1,0,0,0,0|2,0,1]=4 1877 B11R1.40 N\C(\Nc1ccccc1)=N\N Amb25046170 [0,1,0,0,0,0|2,0,1]=4 1878 B11R1.40 O=C(C=O)Nc1cc[n]cc1 Amb24360354 [0,1,0,0,0,0|2,0,1]=4 1879 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [0,1,0,0,0,0|2,0,1]=4 1880 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|1,0,2]=4 1881 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|1,0,2]=4 1882 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [0,1,0,0,0,0|1,0,2]=4 1883 B11R1.40 O=C(Nc1ccccc1)NCl Amb25756195 [0,1,0,0,0,0|2,0,1]=4 1884 B11R1.40 O=C(Nc1ccccc1)SCl Amb25095177 [0,1,0,0,0,0|2,0,1]=4 1885 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|2,0,1]=4 1886 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [0,1,0,0,0,0|3,0,0]=4 1887 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,1,0,0,0,0|2,0,0]=3 1888 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,1,0,0,0,0|2,0,0]=3 1889 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [0,1,0,0,0,0|3,0,0]=4 1890 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,1,0,0,0,0|2,0,0]=3 1891 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,1,0,0,0,0|2,0,0]=3 1892 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,1,0,0,0,0|2,0,0]=3 1893 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,1,0,0,0,0|2,0,0]=3 1894 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [0,1,0,0,0,0|2,0,1]=4 1895 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [0,1,0,0,0,0|2,0,1]=4 1896 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [0,1,0,0,0,0|2,0,1]=4 1897 B11R1.40 OC(CBr)Oc1ccccc1 Amb24724811 [0,1,0,0,0,0|2,0,1]=4 1898 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|2,0,1]=4 1899 B11R1.40 OC(CCl)Oc1ccccc1 Amb24635839 [0,1,0,0,0,0|2,0,1]=4 1900 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|2,0,1]=4 1901 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,1,0,0,0,0|2,0,1]=4 1902 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [0,1,0,0,0,0|3,0,0]=4 1903 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [0,1,0,0,0,0|3,0,0]=4 1904 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,1,0,0,0,0|2,0,0]=3 1905 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,2]=4 1906 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,1,0,0,0,0|2,0,1]=4 1907 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,1,0,0,0,0|2,0,1]=4 1908 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|2,0,1]=4 1909 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,1,0,0,0,0|2,0,1]=4 1910 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,1,0,0,0,0|1,0,1]=3 1911 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,1,0,0,0,0|2,0,1]=4 1912 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,1,0,0,0,0|2,0,1]=4 1913 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,1,0,0,0,0|2,0,1]=4 1914 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,1,0,0,0,0|2,0,1]=4 1915 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|2,0,1]=4 1916 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,1,0,0,0,0|2,0,1]=4 1917 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|2,0,1]=4 1918 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,1,0,0,0,0|2,0,0]=3 1919 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [0,1,0,0,0,0|2,0,1]=4 1920 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [0,1,0,0,0,0|2,0,1]=4 1921 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,0,2]=4 1922 B11R1.91 C=C(Br)CNc1[n]ccc[n]1 Amb24488407 [0,1,0,0,0,0|2,0,0]=3 1923 B11R1.91 C=C(Br)CNc1c[n]cc[n]1 Amb25115188 [0,1,0,0,0,0|2,0,0]=3 1924 B11R1.91 C=C(Br)CNc1cc[n]c[n]1 Amb25053596 [0,1,0,0,0,0|2,0,0]=3 1925 B11R1.91 C=C(Br)CNc1cccc[n]1 Amb24488340 [0,1,0,0,0,0|1,0,0]=2 1926 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [0,1,0,0,0,0|1,0,0]=2 1927 B11R1.91 C=C(Cl)CNc1cc[n]cc1 Amb24442783 [0,1,0,0,0,0|1,0,0]=2 1928 B11R1.91 C=C(Cl)CNc1ccc[n][n]1 Amb24442782 [0,1,0,0,0,0|2,0,0]=3 1929 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|0,0,0]=1 1930 B11R1.91 C=C(Cl)CSc1[n]ccc[n]1 Amb24372606 [0,1,0,0,0,0|3,0,0]=4 1931 B11R1.91 C=C(Cl)CSc1cccc[n]1 Amb25372588 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.91 CC(=C)CNc1c[n]cc[n]1 Amb24391237 [0,1,0,0,0,0|2,0,0]=3 1933 B11R1.91 CC(=C)CNc1cc[n]cc1 Amb24740371 [0,1,0,0,0,0|1,0,0]=2 1934 B11R1.91 CC(=C)CNc1ccc[n][n]1 Amb25090420 [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.91 CC(=C)CNc1cccc[n]1 Amb24486042 [0,1,0,0,0,0|1,0,0]=2 1936 B11R1.91 CC(=C)COc1cc[n]cc1 Amb24690034 [0,1,0,0,0,0|2,0,0]=3 1937 B11R1.91 CC(=C)COc1cccc[n]1 Amb25084698 [0,1,0,0,0,0|2,0,0]=3 1938 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|1,0,0]=2 1939 B11R1.91 CC(=C)CSc1[n]ccc[n]1 Amb25306252 [0,1,0,0,0,0|3,0,0]=4 1940 B11R1.91 CC(=C)CSc1cc[n]c[n]1 Amb24483962 [0,1,0,0,0,0|3,0,0]=4 1941 B11R1.91 CC(=C)CSc1cc[n]cc1 Amb25260223 [0,1,0,0,0,0|2,0,0]=3 1942 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [0,1,0,0,0,0|2,0,0]=3 1943 B11R1.91 CC(=C)\C=C\c1ccc[n]c1 Amb24085618 [0,1,0,0,0,0|2,0,1]=4 1944 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [0,1,0,0,0,0|1,0,1]=3 1945 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,0,0,0,0|2,0,1]=4 1946 B11R1.91 CC(=N)NNc1cccc[n]1 Amb25212370 [0,1,0,0,0,0|2,0,1]=4 1947 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,0,0,0,0|2,0,1]=4 1948 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [0,1,0,0,0,0|2,0,1]=4 1949 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,1,0,0,0,0|2,0,1]=4 1950 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,1,0,0,0,0|2,0,1]=4 1951 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,1,0,0,0,0|2,0,1]=4 1952 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|0,0,1]=2 1953 B11R1.91 CC(=O)CSc1cc[n]cc1 Amb25344740 [0,1,0,0,0,0|2,0,1]=4 1954 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,0,0,0,0|2,0,1]=4 1955 B11R1.91 CC(=O)NNc1c[n]ccc1 Amb25272223 [0,1,0,0,0,0|2,0,1]=4 1956 B11R1.91 CC(=O)NNc1cc[n]cc1 Amb24416297 [0,1,0,0,0,0|2,0,1]=4 1957 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [0,1,0,0,0,0|2,0,1]=4 1958 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [0,1,0,0,0,0|2,0,1]=4 1959 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [0,1,0,0,0,0|1,0,2]=4 1960 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,1,0,0,0,0|1,0,2]=4 1961 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [0,1,0,0,0,0|0,0,3]=4 1962 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,1,0,0,0,0|1,0,2]=4 1963 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,0,0,0,0|2,0,1]=4 1964 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [0,1,0,0,0,0|2,0,1]=4 1965 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,1,0,0,0,0|1,0,2]=4 1966 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [0,1,0,0,0,0|0,0,2]=3 1967 B11R1.91 CC(C)=NNc1cc[n]cc1 Amb25667726 [0,1,0,0,0,0|2,0,1]=4 1968 B11R1.91 CC(C)=NNc1ccccc1 Amb20240635 [0,1,0,0,0,0|1,0,1]=3 1969 B11R1.91 CC(C)NNc1ccccc1 Amb24586606 [0,1,0,0,0,0|1,0,2]=4 1970 B11R1.91 CC(CNc1ccccn1)C Amb1843155 [0,1,0,0,0,0|1,0,2]=4 1971 B11R1.91 CC(COc1ccccc1)N Amb10609380 [0,1,0,0,0,0|1,0,2]=4 1972 B11R1.91 CC(COc1ccccc1)N Amb1126967 [0,1,0,0,0,0|1,0,2]=4 1973 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [0,1,0,0,0,0|1,0,2]=4 1974 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [0,1,0,0,0,0|1,0,2]=4 1975 B11R1.91 CC(N)CNc1cc[n]cc1 Amb25288005 [0,1,0,0,0,0|1,0,2]=4 1976 B11R1.91 CC(N)CNc1cccc[n]1 Amb18125324 [0,1,0,0,0,0|1,0,2]=4 1977 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,1,0,0,0,0|0,0,2]=3 1978 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,1,0,0,0,0|1,0,2]=4 1979 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,1,0,0,0,0|1,0,2]=4 1980 B11R1.91 CC(O)CNc1c[n]ccc1 Amb18933159 [0,1,0,0,0,0|1,0,2]=4 1981 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|1,0,2]=4 1982 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [0,1,0,0,0,0|0,0,2]=3 1983 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,1,0,0,0,0|2,0,1]=4 1984 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|2,0,1]=4 1985 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [0,1,0,0,0,0|1,0,2]=4 1986 B11R1.91 C[C@@H](N)CNc1cccc[n]1 Amb25320231 [0,1,0,0,0,0|1,0,2]=4 1987 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [0,1,0,0,0,0|0,0,2]=3 1988 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,1,0,0,0,0|1,0,2]=4 1989 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [0,1,0,0,0,0|1,0,2]=4 1990 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|1,0,2]=4 1991 B11R1.91 C[C@@H](O)CNc1cc[n]cc1 Amb24422164 [0,1,0,0,0,0|1,0,2]=4 1992 B11R1.91 C[C@@H](O)CNc1cccc[n]1 Amb24633004 [0,1,0,0,0,0|1,0,2]=4 1993 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,1,0,0,0,0|1,0,2]=4 1994 B11R1.91 C[C@H](N)CNc1cccc[n]1 Amb24620429 [0,1,0,0,0,0|1,0,2]=4 1995 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [0,1,0,0,0,0|0,0,2]=3 1996 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [0,1,0,0,0,0|1,0,2]=4 1997 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|1,0,2]=4 1998 B11R1.91 C[C@H](O)CNc1cc[n]cc1 Amb25838422 [0,1,0,0,0,0|1,0,2]=4 1999 B11R1.91 C[C@H](O)CNc1cccc[n]1 Amb25698310 [0,1,0,0,0,0|1,0,2]=4 2000 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,1,0,0,0,0|0,0,2]=3 2001 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,1,0,0,0,0|1,0,2]=4 2002 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,1,0,0,0,0|1,0,2]=4 2003 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,1,0,0,0,0|1,1,1]=4 2004 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [0,1,0,0,0,0|1,0,2]=4 2005 B11R1.91 C\C(\N)=N\Nc1ccccc1 Amb24417520 [0,1,0,0,0,0|1,0,1]=3 2006 B11R1.91 C\C(\N)=N\Oc1ccccc1 Amb25042875 [0,1,0,0,0,0|2,0,1]=4 2007 B11R1.91 ClC(Cl)CNc1ccccc1 Amb24720107 [0,1,0,0,0,0|1,0,1]=3 2008 B11R1.91 ClC(Cl)COc1ccccc1 Amb24417608 [0,1,0,0,0,0|2,0,1]=4 2009 B11R1.91 FC(F)CNc1cccc[n]1 Amb24374282 [0,1,0,0,0,0|2,0,1]=4 2010 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,1,0,0,0,0|1,0,1]=3 2011 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,1,0,0,0,0|1,0,1]=3 2012 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,1,0,0,0,0|2,0,1]=4 2013 B11R1.91 FC(F)CSc1ccccc1 Amb25668847 [0,1,0,0,0,0|2,0,1]=4 2014 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [0,1,0,0,0,0|3,0,0]=4 2015 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,0,0,0,0|3,0,0]=4 2016 B11R1.91 NC(=N)C=Cc1ccccc1 Amb22464717 [0,1,0,0,0,0|2,0,1]=4 2017 B11R1.91 NC(=N)CCc1cccc[n]1 Amb22304703 [0,1,0,0,0,0|3,0,0]=4 2018 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [0,1,0,0,0,0|1,0,0]=2 2019 B11R1.91 NC(=N)CSc1cc[n]cc1 Amb24675096 [0,1,0,0,0,0|3,0,0]=4 2020 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [0,1,0,0,0,0|3,0,0]=4 2021 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [0,1,0,0,0,0|3,0,0]=4 2022 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [0,1,0,0,0,0|3,0,0]=4 2023 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [0,1,0,0,0,0|3,0,0]=4 2024 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22755484 [0,1,0,0,0,0|2,0,1]=4 2025 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22756994 [0,1,0,0,0,0|2,0,1]=4 2026 B11R1.91 NC(=N)\N=C\c1ccccc1 Amb24435682 [0,1,0,0,0,0|3,0,0]=4 2027 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [0,1,0,0,0,0|3,0,0]=4 2028 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,1,0,0,0,0|3,0,0]=4 2029 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,1,0,0,0,0|3,0,0]=4 2030 B11R1.91 NC(=O)CNc1cc[n]c[n]1 Amb18973884 [0,1,0,0,0,0|3,0,0]=4 2031 B11R1.91 NC(=O)CNc1ccc[n][n]1 Amb18298645 [0,1,0,0,0,0|3,0,0]=4 2032 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [0,1,0,0,0,0|3,0,0]=4 2033 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,0,0,0,0|3,0,0]=4 2034 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [0,1,0,0,0,0|3,0,0]=4 2035 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|2,0,0]=3 2036 B11R1.91 NC(=S)CCc1cccnc1 Amb17232623 [0,1,0,0,0,0|3,0,0]=4 2037 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [0,1,0,0,0,0|3,0,0]=4 2038 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [0,1,0,0,0,0|1,0,0]=2 2039 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|2,0,0]=3 2040 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,0,0,0,0|3,0,0]=4 2041 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [0,1,0,0,0,0|3,0,0]=4 2042 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,1,0,0,0,0|2,0,1]=4 2043 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,0,0,0,0|3,0,0]=4 2044 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [0,1,0,0,0,0|3,0,0]=4 2045 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,0,0,0,0|3,0,0]=4 2046 B11R1.91 NC(N)=NNc1ccccc1 Amb24726173 [0,1,0,0,0,0|2,0,0]=3 2047 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [0,1,0,0,0,0|3,0,0]=4 2048 B11R1.91 O=C(Cl)CSc1cc[n]cc1 Amb22396542 [0,1,0,0,0,0|3,0,0]=4 2049 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb19650937 [0,1,0,0,0,0|3,0,0]=4 2050 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb21959947 [0,1,0,0,0,0|3,0,0]=4 2051 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [0,1,0,0,0,0|3,0,0]=4 2052 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,1,0,0,0,0|2,0,0]=3 2053 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,1,0,0,0,0|3,0,0]=4 2054 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,1,0,0,0,0|3,0,0]=4 2055 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,1,0,0,0,0|2,0,0]=3 2056 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,1,0,0,0,0|3,0,0]=4 2057 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|3,0,0]=4 2058 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|3,0,0]=4 2059 B11R1.91 OC(=O)CNC=1CC=CCC1 Amb21929324 [0,1,0,0,0,0|1,0,2]=4 2060 B11R1.91 OC(=O)CNc1c[n]c[n]c1 Amb18933571 [0,1,0,0,0,0|3,0,0]=4 2061 B11R1.91 OC(=O)CNc1cc[n]c[n]1 Amb18973871 [0,1,0,0,0,0|3,0,0]=4 2062 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [0,1,0,0,0,0|2,0,0]=3 2063 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [0,1,0,0,0,0|2,0,0]=3 2064 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [0,1,0,0,0,0|2,0,0]=3 2065 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [0,1,0,0,0,0|2,0,0]=3 2066 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [0,1,0,0,0,0|2,0,0]=3 2067 B11R1.91 OC(=O)CNc1ncccn1 Amb2372087 [0,1,0,0,0,0|3,0,0]=4 2068 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [0,1,0,0,0,0|3,0,0]=4 2069 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [0,1,0,0,0,0|3,0,0]=4 2070 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [0,1,0,0,0,0|3,0,0]=4 2071 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|2,0,0]=3 2072 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|2,0,0]=3 2073 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,1,0,0,0,0|1,1,0]=3 2074 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [0,1,0,0,0,0|3,0,0]=4 2075 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [0,1,0,0,0,0|3,0,0]=4 2076 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|2,0,0]=3 2077 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [0,1,0,0,0,0|3,0,0]=4 2078 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,1,0,0,0,0|3,0,0]=4 2079 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,1,0,0,0,0|2,0,0]=3 2080 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [0,1,0,0,0,0|2,0,1]=4 2081 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [0,1,0,0,0,0|1,0,2]=4 2082 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,1,0,0,0,0|2,0,1]=4 2083 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,1,0,0,0,0|2,0,0]=3 2084 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,1,0,0,0,0|2,0,0]=3 2085 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,1,0,0,0,0|2,0,0]=3 2086 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [0,1,0,0,0,0|3,0,0]=4 2087 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [0,1,0,0,0,0|3,0,0]=4 2088 B11R1.91 [O-]C(=O)C#Cc1ccccc1 Amb22753901 [0,1,0,0,0,0|2,0,1]=4 2089 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,1,0,0,0,0|2,0,0]=3 2090 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|1,0,0]=2 2091 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [0,1,0,0,0,0|2,0,0]=3 2092 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [0,1,0,0,0,0|2,0,0]=3 2093 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [0,1,0,0,0,0|2,0,1]=4 2094 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [0,1,0,0,0,0|2,0,1]=4 2095 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|3,0,0]=4 2096 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [0,1,0,0,0,0|3,0,0]=4 2097 B11R1.91 [O-][N+](=O)NNc1ccccc1 Amb21953657 [0,1,0,0,0,0|3,0,0]=4 2098 B11R1.91 [S-]C(=S)NNc1ccccc1 Amb10552747 [0,1,0,0,0,0|2,0,0]=3 2099 B11R1.91 [S-]C(=S)NNc1ccccc1 Amb22486868 [0,1,0,0,0,0|2,0,0]=3 2100 B9R0.18 C=CCCC(=O)\C=C\C=C Amb24583790 [0,0,1,0,0,0|2,0,0]=3 2101 B9R0.18 C=CCCC(O)\C=C\C=C Amb25283788 [0,0,1,0,0,0|2,0,1]=4 2102 B9R0.18 C=CCNC(=O)OCC=C Amb25359097 [0,0,1,0,0,0|2,0,1]=4 2103 B9R0.18 C=CCNC(=O)\C=C\CN Amb24610341 [0,0,1,0,0,0|2,0,1]=4 2104 B9R0.18 C=C\C=C\C(=O)C=CC=C Amb25339604 [0,0,1,0,0,0|2,0,1]=4 2105 B9R0.18 C\C(=C/CC=C)\C=C\C=O Amb24686431 [0,0,1,0,0,0|2,0,1]=4 2106 B9R0.18 C\C(=C\CC=C)\C=CC=O Amb24697930 [0,0,1,0,0,0|2,0,1]=4 2107 B9R0.45 C=CCC\C=C\CCC=C Amb22052647 [0,0,1,0,0,0|1,0,2]=4 2108 B11R2.1 BN1CCc2ccccc12 Amb25180693 [0,0,0,1,0,0|3,0,0]=4 2109 B11R2.1 Brc1[n][nH]c2cc[n]cc21 Amb19894953 [0,0,0,1,0,0|3,0,0]=4 2110 B11R2.1 Brc1[n][nH]c2ccc[n]c21 Amb19894714 [0,0,0,1,0,0|3,0,0]=4 2111 B11R2.1 Brc1[n][s]c2ccccc21 Amb18769624 [0,0,0,1,0,0|3,0,0]=4 2112 B11R2.1 Brc1[n]oc2ccccc21 Amb18187786 [0,0,0,1,0,0|3,0,0]=4 2113 B11R2.1 Brc1[s][n]c2ccccc21 Amb22496211 [0,0,0,1,0,0|2,0,1]=4 2114 B11R2.1 Brc1c[nH]c2c1cccc2 Amb2447679 [0,0,0,1,0,0|1,0,1]=3 2115 B11R2.1 Brc1c[nH]c2c1nccc2 Amb10070447 [0,0,0,1,0,0|2,0,1]=4 2116 B11R2.1 Brc1n[nH]c2c1cccc2 Amb1147463 [0,0,0,1,0,0|2,0,0]=3 2117 B11R2.1 Brc1n[nH]c2c1cccn2 Amb16185749 [0,0,0,1,0,0|3,0,0]=4 2118 B11R2.1 Brc1n[nH]c2c1ccnc2 Amb16185748 [0,0,0,1,0,0|3,0,0]=4 2119 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|1,0,0]=2 2120 B11R2.1 C=C1CN=C2C=CC=CN21 Amb24102438 [0,0,0,1,0,0|1,0,1]=3 2121 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [0,0,0,1,0,0|1,0,2]=4 2122 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|0,0,2]=3 2123 B11R2.1 CC1CSc2ccccc12 Amb17939280 [0,0,0,1,0,0|1,0,2]=4 2124 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [0,0,0,1,0,0|2,0,1]=4 2125 B11R2.1 CN1CNc2ccccc12 Amb25260683 [0,0,0,1,0,0|1,0,1]=3 2126 B11R2.1 C[C@@H]1CNc2ccccc21 Amb25069285 [0,0,0,1,0,0|0,0,2]=3 2127 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [0,0,0,1,0,0|1,1,1]=4 2128 B11R2.1 Cc1[nH][n]c2ccccc21 Amb19316313 [0,0,0,1,0,0|1,0,2]=4 2129 B11R2.1 Cc1[nH]nc2c1cccc2 Amb15691959 [0,0,0,1,0,0|1,0,2]=4 2130 B11R2.1 Cc1[n][nH]c2c[n]ccc21 Amb21856879 [0,0,0,1,0,0|2,0,1]=4 2131 B11R2.1 Cc1[n][nH]c2cc[n]cc21 Amb21520435 [0,0,0,1,0,0|2,0,1]=4 2132 B11R2.1 Cc1[n][nH]c2ccc[n]c21 Amb19957740 [0,0,0,1,0,0|2,0,1]=4 2133 B11R2.1 Cc1[s][n]c2ccccc21 Amb25275391 [0,0,0,1,0,0|1,0,2]=4 2134 B11R2.1 Cc1c[nH]c2c1cccc2 Amb1786299 [0,0,0,1,0,0|0,0,2]=3 2135 B11R2.1 Cc1c[nH]c2c1nccc2 Amb15692260 [0,0,0,1,0,0|1,0,2]=4 2136 B11R2.1 Cc1c[nH]c2c[n]ccc21 Amb22499601 [0,0,0,1,0,0|1,0,2]=4 2137 B11R2.1 Cc1c[nH]c2cc[n]cc21 Amb21963356 [0,0,0,1,0,0|1,0,2]=4 2138 B11R2.1 Clc1[n][nH]c2c[n]ccc21 Amb21963005 [0,0,0,1,0,0|3,0,0]=4 2139 B11R2.1 Clc1[n][nH]c2ccc[n]c21 Amb22170087 [0,0,0,1,0,0|3,0,0]=4 2140 B11R2.1 Clc1c[nH]c2c1nccc2 Amb15692259 [0,0,0,1,0,0|2,0,1]=4 2141 B11R2.1 Clc1c[nH]c2c[n]ccc21 Amb24436580 [0,0,0,1,0,0|2,0,1]=4 2142 B11R2.1 Clc1c[nH]c2ccccc12 Amb17672708 [0,0,0,1,0,0|1,0,1]=3 2143 B11R2.1 Clc1coc2ccccc21 Amb21963868 [0,0,0,1,0,0|2,0,1]=4 2144 B11R2.1 Clc1nsc2c1cccc2 Amb1105427 [0,0,0,1,0,0|3,0,0]=4 2145 B11R2.1 Clc1o[n]c2ccccc21 Amb25221266 [0,0,0,1,0,0|2,0,1]=4 2146 B11R2.1 Clc1snc2c1cccc2 Amb13952486 [0,0,0,1,0,0|2,0,1]=4 2147 B11R2.1 FC1CCc2ccccc21 Amb25311534 [0,0,0,1,0,0|2,0,1]=4 2148 B11R2.1 FC1CNc2ccccc21 Amb20242176 [0,0,0,1,0,0|1,0,1]=3 2149 B11R2.1 Fc1[n][nH]c2[n]cccc21 Amb22500821 [0,0,0,1,0,0|3,0,0]=4 2150 B11R2.1 Fc1[n][nH]c2ccccc21 Amb22493910 [0,0,0,1,0,0|2,0,0]=3 2151 B11R2.1 Fc1c[nH]c2[n]cccc21 Amb23571876 [0,0,0,1,0,0|2,0,1]=4 2152 B11R2.1 Fc1c[nH]c2c1cccc2 Amb10841217 [0,0,0,1,0,0|1,0,1]=3 2153 B11R2.1 Fc1c[nH]c2c[n]ccc21 Amb24328779 [0,0,0,1,0,0|2,0,1]=4 2154 B11R2.1 Fc1c[nH]c2cc[n]cc21 Amb24328753 [0,0,0,1,0,0|2,0,1]=4 2155 B11R2.1 Fc1c[nH]c2ccc[n]c21 Amb24328733 [0,0,0,1,0,0|2,0,1]=4 2156 B11R2.1 Fc1coc2ccccc21 Amb24409168 [0,0,0,1,0,0|2,0,1]=4 2157 B11R2.1 Ic1[n][nH]c2c[n]ccc21 Amb19895126 [0,0,0,1,0,0|3,0,0]=4 2158 B11R2.1 Ic1[n][nH]c2cc[n]cc21 Amb24367120 [0,0,0,1,0,0|3,0,0]=4 2159 B11R2.1 Ic1[n][nH]c2ccc[n]c21 Amb21857900 [0,0,0,1,0,0|3,0,0]=4 2160 B11R2.1 Ic1[n]oc2ccccc21 Amb25320384 [0,0,0,1,0,0|3,0,0]=4 2161 B11R2.1 Ic1c[nH]c2c1cccc2 Amb17134442 [0,0,0,1,0,0|1,0,1]=3 2162 B11R2.1 Ic1c[nH]c2c1ccnc2 Amb10067432 [0,0,0,1,0,0|2,0,1]=4 2163 B11R2.1 Ic1c[nH]c2c1nccc2 Amb15692251 [0,0,0,1,0,0|2,0,1]=4 2164 B11R2.1 Ic1c[s]c2ccccc21 Amb22002561 [0,0,0,1,0,0|2,0,1]=4 2165 B11R2.1 Ic1coc2ccccc21 Amb24622374 [0,0,0,1,0,0|2,0,1]=4 2166 B11R2.1 Ic1n[nH]c2c1cccn2 Amb17616136 [0,0,0,1,0,0|3,0,0]=4 2167 B11R2.1 N=S1CNc2ccccc12 Amb24465157 [0,0,0,1,0,0|2,0,0]=3 2168 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [0,0,0,1,0,0|2,0,1]=4 2169 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [0,0,0,1,0,0|2,0,1]=4 2170 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|2,0,1]=4 2171 B11R2.1 NC1CNc2ccccc21 Amb24555894 [0,0,0,1,0,0|1,0,1]=3 2172 B11R2.1 NC1COc2c1cccc2 Amb13951643 [0,0,0,1,0,0|2,0,1]=4 2173 B11R2.1 NC1COc2c1cccc2 Amb2383232 [0,0,0,1,0,0|2,0,1]=4 2174 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [0,0,0,1,0,0|2,0,1]=4 2175 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|2,0,1]=4 2176 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|2,0,1]=4 2177 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|2,0,1]=4 2178 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|2,0,1]=4 2179 B11R2.1 Nc1[nH]cc2ccccc21 Amb24479060 [0,0,0,1,0,0|3,0,0]=4 2180 B11R2.1 Nc1[n][nH]c2cc[n]cc21 Amb18203150 [0,0,0,1,0,0|3,0,0]=4 2181 B11R2.1 Nc1[n][nH]c2ccc[n]c21 Amb19516357 [0,0,0,1,0,0|3,0,0]=4 2182 B11R2.1 Nc1[n][nH]c2ccccc21 Amb22491340 [0,0,0,1,0,0|2,0,0]=3 2183 B11R2.1 Nc1[n][nH]c2ccccc21 Amb22491341 [0,0,0,1,0,0|2,0,0]=3 2184 B11R2.1 Nc1c[nH]c2c1cccn2 Amb10068393 [0,0,0,1,0,0|2,0,1]=4 2185 B11R2.1 Nc1c[nH]c2c1cccn2 Amb10603666 [0,0,0,1,0,0|2,0,1]=4 2186 B11R2.1 Nc1c[nH]c2c1ccnc2 Amb10070449 [0,0,0,1,0,0|2,0,1]=4 2187 B11R2.1 Nc1c[nH]c2c1ccnc2 Amb16185636 [0,0,0,1,0,0|2,0,1]=4 2188 B11R2.1 Nc1c[nH]c2c1cncc2 Amb16185635 [0,0,0,1,0,0|2,0,1]=4 2189 B11R2.1 Nc1c[nH]c2c1nccc2 Amb10070448 [0,0,0,1,0,0|2,0,1]=4 2190 B11R2.1 Nc1c[nH]c2c1nccc2 Amb16185634 [0,0,0,1,0,0|2,0,1]=4 2191 B11R2.1 Nc1c[s]c2ccccc21 Amb19957699 [0,0,0,1,0,0|2,0,1]=4 2192 B11R2.1 Nc1coc2ccccc21 Amb24371464 [0,0,0,1,0,0|2,0,1]=4 2193 B11R2.1 Nc1csc2c1cccc2 Amb13890519 [0,0,0,1,0,0|2,0,1]=4 2194 B11R2.1 Nc1n[nH]c2c1cccc2 Amb1103847 [0,0,0,1,0,0|2,0,0]=3 2195 B11R2.1 Nc1n[nH]c2c1cccn2 Amb1092016 [0,0,0,1,0,0|3,0,0]=4 2196 B11R2.1 Nc1noc2c1cccc2 Amb1323334 [0,0,0,1,0,0|3,0,0]=4 2197 B11R2.1 Nc1nsc2c1cccc2 Amb1147286 [0,0,0,1,0,0|3,0,0]=4 2198 B11R2.1 Nc1o[n]c2ccccc21 Amb21857107 [0,0,0,1,0,0|2,0,1]=4 2199 B11R2.1 Nc1occ2ccccc21 Amb24463840 [0,0,0,1,0,0|3,0,0]=4 2200 B11R2.1 Nc1snc2c1cccc2 Amb1100345 [0,0,0,1,0,0|2,0,1]=4 2201 B11R2.1 O=C1C=Cc2c1cccc2 Amb10603436 [0,0,0,1,0,0|2,0,1]=4 2202 B11R2.1 O=C1CCc2[n]cccc21 Amb22275948 [0,0,0,1,0,0|3,0,0]=4 2203 B11R2.1 O=C1CCc2c1nccc2 Amb10602809 [0,0,0,1,0,0|3,0,0]=4 2204 B11R2.1 O=C1CCc2c[n]ccc21 Amb22235532 [0,0,0,1,0,0|3,0,0]=4 2205 B11R2.1 O=C1CCc2cc[n]cc21 Amb22491415 [0,0,0,1,0,0|3,0,0]=4 2206 B11R2.1 O=C1CN=C2NC=CC=C21 Amb22491902 [0,0,0,1,0,0|2,0,1]=4 2207 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [0,0,0,1,0,0|1,0,0]=2 2208 B11R2.1 O=C1CNc2c[n]ccc21 Amb25307231 [0,0,0,1,0,0|2,0,0]=3 2209 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [0,0,0,1,0,0|1,0,0]=2 2210 B11R2.1 O=C1COc2[n]cccc21 Amb20242022 [0,0,0,1,0,0|3,0,0]=4 2211 B11R2.1 O=C1COc2c1cccc2 Amb2383539 [0,0,0,1,0,0|2,0,0]=3 2212 B11R2.1 O=C1COc2c[n]ccc21 Amb20242099 [0,0,0,1,0,0|3,0,0]=4 2213 B11R2.1 O=C1COc2c[n]ccc21 Amb22728783 [0,0,0,1,0,0|3,0,0]=4 2214 B11R2.1 O=C1COc2cc[n]cc21 Amb20242098 [0,0,0,1,0,0|3,0,0]=4 2215 B11R2.1 O=C1COc2ccc[n]c21 Amb22372216 [0,0,0,1,0,0|3,0,0]=4 2216 B11R2.1 O=C1CSc2cc[n]cc21 Amb25807909 [0,0,0,1,0,0|3,0,0]=4 2217 B11R2.1 O=C1CSc2ccc[n]c21 Amb24480609 [0,0,0,1,0,0|3,0,0]=4 2218 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,1,0,0|3,0,0]=4 2219 B11R2.1 O=C1N=Nc2ccccc21 Amb21928183 [0,0,0,1,0,0|2,0,1]=4 2220 B11R2.1 O=C1NNc2[n]cccc21 Amb19267105 [0,0,0,1,0,0|3,0,0]=4 2221 B11R2.1 O=C1NNc2c[n]ccc21 Amb21857177 [0,0,0,1,0,0|3,0,0]=4 2222 B11R2.1 O=C1NNc2ccc[n]c21 Amb21857168 [0,0,0,1,0,0|3,0,0]=4 2223 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [0,0,0,1,0,0|2,0,0]=3 2224 B11R2.1 O=C1NS[13c]2[13cH][13cH][13cH][13cH]c21 Amb19130670 [0,0,0,1,0,0|3,0,0]=4 2225 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [0,0,0,1,0,0|3,0,0]=4 2226 B11R2.1 O=C1O[Hg]c2ccccc21 Amb22369198 [0,0,0,1,0,0|3,0,0]=4 2227 B11R2.1 O=C1SCc2c1cccc2 Amb2421358 [0,0,0,1,0,0|3,0,0]=4 2228 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [0,0,0,1,0,0|2,0,0]=3 2229 B11R2.1 O=C1SSc2ccccc21 Amb20660516 [0,0,0,1,0,0|3,0,0]=4 2230 B11R2.1 O=S1CNc2ccccc12 Amb24091032 [0,0,0,1,0,0|2,0,0]=3 2231 B11R2.1 O=c1s[nH]c2c1cccc2 Amb1071736 [0,0,0,1,0,0|2,0,0]=3 2232 B11R2.1 OB1COc2ccccc21 Amb25132941 [0,0,0,1,0,0|3,0,0]=4 2233 B11R2.1 OC1COc2ccccc21 Amb24104532 [0,0,0,1,0,0|2,0,1]=4 2234 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [0,0,0,1,0,0|2,0,1]=4 2235 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [0,0,0,1,0,0|2,0,1]=4 2236 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [0,0,0,1,0,0|2,0,1]=4 2237 B11R2.1 O[n+]1c[nH]c2ccccc12 Amb24729556 [0,0,0,1,0,0|2,0,1]=4 2238 B11R2.1 Oc1[n][nH]c2cc[n]cc21 Amb21856930 [0,0,0,1,0,0|3,0,0]=4 2239 B11R2.1 Oc1[n][s]c2ccccc21 Amb22166851 [0,0,0,1,0,0|3,0,0]=4 2240 B11R2.1 Oc1[s][n]c2ccccc21 Amb22059084 [0,0,0,1,0,0|2,0,1]=4 2241 B11R2.1 Oc1c[nH]c2[n]cccc21 Amb24387306 [0,0,0,1,0,0|2,0,1]=4 2242 B11R2.1 Oc1coc2ccccc21 Amb24097480 [0,0,0,1,0,0|2,0,1]=4 2243 B11R2.1 S=C1N=Nc2ccccc21 Amb24661314 [0,0,0,1,0,0|2,0,1]=4 2244 B11R2.1 S=C1NCc2ccccc21 Amb24662530 [0,0,0,1,0,0|3,0,0]=4 2245 B11R2.1 S=C1SSc2ccccc21 Amb19652300 [0,0,0,1,0,0|3,0,0]=4 2246 B11R2.1 S=c1[nH][nH]c2ccccc21 Amb24082861 [0,0,0,1,0,0|2,0,0]=3 2247 B11R2.1 S=c1[nH]oc2ccccc21 Amb24060603 [0,0,0,1,0,0|3,0,0]=4 2248 B11R2.1 Sc1c[s]c2ccccc21 Amb24396652 [0,0,0,1,0,0|2,0,1]=4 2249 B11R2.1 Sc1coc2ccccc21 Amb24061893 [0,0,0,1,0,0|2,0,1]=4 2250 B11R2.1 Sc1nsc2c1cccc2 Amb1136898 [0,0,0,1,0,0|3,0,0]=4 2251 B11R2.1 Sc1o[n]c2ccccc21 Amb25363518 [0,0,0,1,0,0|2,0,1]=4 2252 B11R2.1 [N-]=[N+]1ONc2ccccc12 Amb21953654 [0,0,0,1,0,0|3,0,0]=4 2253 B11R2.1 [NH3+]C1=NCc2c1cccc2 Amb2540026 [0,0,0,1,0,0|3,0,0]=4 2254 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,1]=4 2255 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,1]=4 2256 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|1,0,0]=2 2257 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|1,0,2]=4 2258 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|2,0,1]=4 2259 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|2,0,1]=4 2260 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|2,0,1]=4 2261 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|2,0,1]=4 2262 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|2,0,1]=4 2263 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|3,0,0]=4 2264 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|2,0,1]=4 2265 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|2,0,1]=4 2266 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|2,0,1]=4 2267 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|2,0,1]=4 2268 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|2,0,1]=4 2269 B11R2.4 O=C1C=C1c2ccccc2 Amb24722866 [0,0,0,1,0,0|2,0,1]=4 2270 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|2,0,0]=3 2271 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|2,0,1]=4 2272 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|2,0,1]=4 2273 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [0,0,0,1,0,0|1,0,0]=2 2274 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [0,0,0,1,0,0|0,0,0]=1 2275 B11R2.20 C1=NNc2[n]cccc2O1 Amb24559880 [0,0,0,1,0,0|3,0,0]=4 2276 B11R2.20 C1=NSc2ccccc2S1 Amb25187368 [0,0,0,1,0,0|3,0,0]=4 2277 B11R2.20 C1=Nc2c(CN1)cccc2 Amb10552960 [0,0,0,1,0,0|3,0,0]=4 2278 B11R2.20 C1=Nc2c(NC1)cccc2 Amb10174686 [0,0,0,1,0,0|1,0,0]=2 2279 B11R2.20 C1=Nc2c(SC1)cccc2 Amb10976509 [0,0,0,1,0,0|2,0,0]=3 2280 B11R2.20 C1C=CN2C=COC=C2O1 Amb24093674 [0,0,0,1,0,0|3,0,0]=4 2281 B11R2.20 C1C=CNc2ccccc21 Amb24700458 [0,0,0,1,0,0|0,0,2]=3 2282 B11R2.20 C1C=COc2ccccc21 Amb24715811 [0,0,0,1,0,0|1,0,2]=4 2283 B11R2.20 C1C=CSc2ccccc21 Amb25349026 [0,0,0,1,0,0|1,0,2]=4 2284 B11R2.20 C1C=Cc2[n]c[n]cc2S1 Amb24081668 [0,0,0,1,0,0|3,0,0]=4 2285 B11R2.20 C1C=Cc2[n]cccc2O1 Amb22896485 [0,0,0,1,0,0|2,0,0]=3 2286 B11R2.20 C1C=Cc2c[n]c[n]c2O1 Amb24066305 [0,0,0,1,0,0|3,0,0]=4 2287 B11R2.20 C1C=Cc2c[n]c[n]c2S1 Amb24066312 [0,0,0,1,0,0|3,0,0]=4 2288 B11R2.20 C1C=Cc2c[n]ccc2N1 Amb25077220 [0,0,0,1,0,0|1,0,0]=2 2289 B11R2.20 C1C=Cc2c[n]ccc2O1 Amb24665756 [0,0,0,1,0,0|2,0,0]=3 2290 B11R2.20 C1C=Cc2cc[n]cc2O1 Amb24065645 [0,0,0,1,0,0|2,0,0]=3 2291 B11R2.20 C1C=Cc2ccc[n]c2N1 Amb25793132 [0,0,0,1,0,0|1,0,0]=2 2292 B11R2.20 C1C=Nc2[n]c[n]cc2N1 Amb24664450 [0,0,0,1,0,0|3,0,0]=4 2293 B11R2.20 C1C=Nc2[n]cccc2O1 Amb25707817 [0,0,0,1,0,0|3,0,0]=4 2294 B11R2.20 C1C=Nc2c[n]c[n]c2N1 Amb25066994 [0,0,0,1,0,0|3,0,0]=4 2295 B11R2.20 C1C=Nc2c[n]ccc2N1 Amb25770276 [0,0,0,1,0,0|2,0,0]=3 2296 B11R2.20 C1CC=C2C=NC=CC2=C1 Amb24612787 [0,0,0,1,0,0|2,0,1]=4 2297 B11R2.20 C1CC=Cc2[n]cccc21 Amb25837322 [0,0,0,1,0,0|2,0,0]=3 2298 B11R2.20 C1CC=Cc2c[n]ccc21 Amb25064667 [0,0,0,1,0,0|2,0,0]=3 2299 B11R2.20 C1CCCc2ccccc21 Amb22351371 [0,0,0,1,0,0|1,0,2]=4 2300 B11R2.20 C1CCNc2c[n]ccc21 Amb21864834 [0,0,0,1,0,0|1,0,2]=4 2301 B11R2.20 C1CCNc2c[n]ccc21 Amb22491315 [0,0,0,1,0,0|1,0,2]=4 2302 B11R2.20 C1CCNc2c[n]ccc21 Amb22751690 [0,0,0,1,0,0|1,0,2]=4 2303 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [0,0,0,1,0,0|0,0,2]=3 2304 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [0,0,0,1,0,0|0,0,2]=3 2305 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [0,0,0,1,0,0|1,0,2]=4 2306 B11R2.20 C1CNNc2ccccc21 Amb24564127 [0,0,0,1,0,0|1,0,2]=4 2307 B11R2.20 C1CNc2c(C1)cccn2 Amb15692065 [0,0,0,1,0,0|1,0,2]=4 2308 B11R2.20 C1CNc2c(N1)nccc2 Amb10603351 [0,0,0,1,0,0|2,0,1]=4 2309 B11R2.20 C1CNc2c(O1)cccc2 Amb2371970 [0,0,0,1,0,0|1,0,1]=3 2310 B11R2.20 C1CNc2c(S1)cccc2 Amb1104964 [0,0,0,1,0,0|1,0,1]=3 2311 B11R2.20 C1CNc2c[n]ccc2N1 Amb20622788 [0,0,0,1,0,0|2,0,1]=4 2312 B11R2.20 C1COc2c(N1)cccn2 Amb13890253 [0,0,0,1,0,0|2,0,1]=4 2313 B11R2.20 C1COc2c(N1)ccnc2 Amb13890252 [0,0,0,1,0,0|2,0,1]=4 2314 B11R2.20 C1COc2cc[n]cc2N1 Amb20622566 [0,0,0,1,0,0|2,0,1]=4 2315 B11R2.20 C1COc2ccccc2N1 Amb18090793 [0,0,0,1,0,0|1,0,1]=3 2316 B11R2.20 C1CSc2[n]cccc2N1 Amb19148121 [0,0,0,1,0,0|2,0,1]=4 2317 B11R2.20 C1CSc2cc[n]cc2N1 Amb20667582 [0,0,0,1,0,0|2,0,1]=4 2318 B11R2.20 C1CSc2ccccc2O1 Amb19374957 [0,0,0,1,0,0|2,0,1]=4 2319 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [0,0,0,1,0,0|2,0,0]=3 2320 B11R2.20 C1N=C2C=CC=NC2=CO1 Amb24607302 [0,0,0,1,0,0|2,0,1]=4 2321 B11R2.20 C1N=C2C=CN=CC2=CO1 Amb25097053 [0,0,0,1,0,0|2,0,1]=4 2322 B11R2.20 C1N=CNc2ccccc21 Amb19374085 [0,0,0,1,0,0|1,0,2]=4 2323 B11R2.20 C1N=Cc2[n]cccc2O1 Amb24424648 [0,0,0,1,0,0|3,0,0]=4 2324 B11R2.20 C1N=Cc2[n]cccc2S1 Amb24100799 [0,0,0,1,0,0|3,0,0]=4 2325 B11R2.20 C1N=Cc2cc[n]cc2S1 Amb24100804 [0,0,0,1,0,0|3,0,0]=4 2326 B11R2.20 C1NCNc2[n]cccc21 Amb24746456 [0,0,0,1,0,0|2,0,1]=4 2327 B11R2.20 C1NCNc2ccccc21 Amb25147572 [0,0,0,1,0,0|1,0,1]=3 2328 B11R2.20 C1NCOc2ccccc21 Amb24087478 [0,0,0,1,0,0|2,0,1]=4 2329 B11R2.20 C1Nc2ccccc2C=N1 Amb25147432 [0,0,0,1,0,0|1,0,0]=2 2330 B11R2.20 C1OC=Cc2c[n]ccc21 Amb24509709 [0,0,0,1,0,0|3,0,0]=4 2331 B11R2.20 C1OCOc2ccccc21 Amb24066080 [0,0,0,1,0,0|2,0,1]=4 2332 B11R2.20 C1ON=Cc2ccccc21 Amb25217160 [0,0,0,1,0,0|3,0,0]=4 2333 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [0,0,0,1,0,0|1,0,0]=2 2334 B11R2.20 C1PCNc2ccccc21 Amb25737691 [0,0,0,1,0,0|1,0,1]=3 2335 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [0,0,0,1,0,0|2,0,0]=3 2336 B11R2.20 C1SCCc2ccccc21 Amb24085482 [0,0,0,1,0,0|2,0,1]=4 2337 B11R2.20 C=1N=CNC2=CC=COC21 Amb24564703 [0,0,0,1,0,0|2,0,1]=4 2338 B11R2.20 C=1N=CNC2=COC=CC21 Amb24505153 [0,0,0,1,0,0|2,0,1]=4 2339 B11R2.20 C=1NC=CC2=COC=CC21 Amb25060111 [0,0,0,1,0,0|3,0,0]=4 2340 B11R2.20 C=1NNc2[n]cccc2N1 Amb25116885 [0,0,0,1,0,0|3,0,0]=4 2341 B11R2.20 C=1Nc2ccccc2NN1 Amb24479128 [0,0,0,1,0,0|2,0,0]=3 2342 B11R2.20 C=1OC=CC2=CC=CNC21 Amb25074513 [0,0,0,1,0,0|1,0,1]=3 2343 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [0,0,0,1,0,0|2,0,1]=4 2344 B11R2.20 [13cH]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17618237 [0,0,0,1,0,0|1,0,1]=3 2345 B11R2.20 c1[nH+]ccc2ccccc21 Amb22456232 [0,0,0,1,0,0|2,0,0]=3 2346 B11R2.20 c1[n][n][n]c2ccccc21 Amb24378063 [0,0,0,1,0,0|2,0,1]=4 2347 B11R2.20 c1[n]c[n]c2NOC=Cc21 Amb24089130 [0,0,0,1,0,0|3,0,0]=4 2348 B11R2.20 c1[n]ccc2C=CNNc21 Amb24461248 [0,0,0,1,0,0|2,0,0]=3 2349 B11R2.20 c1[n]ccc2N=CNNc21 Amb25254888 [0,0,0,1,0,0|3,0,0]=4 2350 B11R2.20 c1[n]ccc2NC=COc21 Amb24089126 [0,0,0,1,0,0|2,0,1]=4 2351 B11R2.20 c1[n]ccc2NOC=Cc21 Amb24417778 [0,0,0,1,0,0|2,0,0]=3 2352 B11R2.20 c1[n]ccc2NSC=Cc21 Amb24089127 [0,0,0,1,0,0|2,0,0]=3 2353 B11R2.20 c1[n]ccc2ONC=Cc21 Amb24100803 [0,0,0,1,0,0|3,0,0]=4 2354 B11R2.20 c1[n]ccc2OOC=Cc21 Amb24060614 [0,0,0,1,0,0|3,0,0]=4 2355 B11R2.20 c1[n]ccc2cc[n]cc21 Amb20240662 [0,0,0,1,0,0|3,0,0]=4 2356 B11R2.20 c1cc[13c]2[13c](c1)[13cH][13cH][13cH][13cH]2 Amb17618236 [0,0,0,1,0,0|1,0,1]=3 2357 B11R2.20 c1cc[n+]2c(c1)nccc2 Amb1630259 [0,0,0,1,0,0|1,0,2]=4 2358 B11R2.20 c1cc[n]c2OC=CNc21 Amb24089117 [0,0,0,1,0,0|2,0,1]=4 2359 B11R2.20 c1cc[n]c2ONC=Cc21 Amb24100801 [0,0,0,1,0,0|3,0,0]=4 2360 B11R2.20 c1cc[n]c2SNC=Cc21 Amb24100802 [0,0,0,1,0,0|3,0,0]=4 2361 B11R2.20 c1cc[n]c2ccc[n]c21 Amb22347852 [0,0,0,1,0,0|1,0,2]=4 2362 B11R2.20 c1ccc2NOC=Cc2[n]1 Amb24364736 [0,0,0,1,0,0|2,0,0]=3 2363 B11R2.20 c1ccc2NSC=Cc2[n]1 Amb24089124 [0,0,0,1,0,0|2,0,0]=3 2364 B11R2.20 c1ccc2OOC=Cc2[n]1 Amb24060613 [0,0,0,1,0,0|3,0,0]=4 2365 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [0,0,0,1,0,0|2,0,0]=3 2366 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [0,0,0,1,0,0|2,0,0]=3 2367 B11R2.20 c1ccc2c(c1)[nH+]ccc2 Amb10839799 [0,0,0,1,0,0|0,0,2]=3 2368 B11R2.20 c1ccc2c(c1)cncc2 Amb10573326 [0,0,0,1,0,0|2,0,0]=3 2369 B11R2.20 c1ccc2c(c1)cnnc2 Amb10552942 [0,0,0,1,0,0|3,0,0]=4 2370 B11R2.20 c1ccc2c(c1)nccc2 Amb17619761 [0,0,0,1,0,0|0,0,2]=3 2371 B11R2.20 c1ccc2c(c1)nccn2 Amb2099438 [0,0,0,1,0,0|1,0,2]=4 2372 B11R2.20 c1cccc2NC=CNc21 Amb25217865 [0,0,0,1,0,0|1,0,1]=3 2373 B11R2.20 c1cccc2[13cH][13cH][13cH][13cH]c21 Amb22367374 [0,0,0,1,0,0|1,0,1]=3 2374 B11R2.20 c1cccc2[13cH]cccc21 Amb22353428 [0,0,0,1,0,0|1,0,1]=3 2375 B11R2.20 c1cccc2[14cH]cccc21 Amb22349781 [0,0,0,1,0,0|1,0,1]=3 2376 B11R2.20 c1cccc2[nH+]cccc21 Amb22411647 [0,0,0,1,0,0|0,0,2]=3 2377 B11R2.20 c1cccc2[nH+]cccc21 Amb22733403 [0,0,0,1,0,0|0,0,2]=3 2378 B11R2.20 c1cccc2[n][n]ccc21 Amb21858429 [0,0,0,1,0,0|1,0,1]=3 2379 B11R2.20 c1cccc2[n][n]ccc21 Amb22001549 [0,0,0,1,0,0|1,0,1]=3 2380 B11R2.20 c1cccc2[n]cccc21 Amb22002632 [0,0,0,1,0,0|0,0,2]=3 2381 B11R2.20 c1cccc2[n]cccc21 Amb22337856 [0,0,0,1,0,0|0,0,2]=3 2382 B11R2.20 c1cnc2c(c1)cccn2 Amb15692873 [0,0,0,1,0,0|1,0,2]=4 2383 B11R2.20 c1cnc2c(c1)nccc2 Amb1106274 [0,0,0,1,0,0|1,0,2]=4 2384 B11R2.20 c1ncc2c(c1)cncc2 Amb10573720 [0,0,0,1,0,0|3,0,0]=4 2385 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [0,0,0,1,0,0|1,0,2]=4 2386 B11R2.238 C1CC1Nc2c[n]ccc2 Amb18270523 [0,0,0,1,0,0|1,0,2]=4 2387 B11R2.238 C1CC1Nc2ccccc2 Amb18270529 [0,0,0,1,0,0|0,0,2]=3 2388 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [0,0,0,1,0,0|2,0,1]=4 2389 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [0,0,0,1,0,0|2,0,1]=4 2390 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [0,0,0,1,0,0|2,0,1]=4 2391 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,1,0,0|2,0,1]=4 2392 B11R2.239 C1CC=C1c2cccc[n]2 Amb24069951 [0,0,0,1,0,0|2,0,1]=4 2393 B11R2.239 C1CCN1c2cccc[n]2 Amb24069933 [0,0,0,1,0,0|1,0,2]=4 2394 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,1,0,0|2,0,1]=4 2395 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,1,0,0|2,0,1]=4 2396 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,1,0,0|2,0,1]=4 2397 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,1,0,0|2,0,1]=4 2398 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [0,0,0,1,0,0|1,0,0]=2 2399 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|1,0,2]=4 2400 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|2,0,1]=4 2401 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [0,0,0,1,0,0|2,0,1]=4 2402 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [0,0,0,1,0,0|2,0,1]=4 2403 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [0,0,0,1,0,0|2,0,1]=4 2404 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [0,0,0,1,0,0|2,0,1]=4 2405 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [0,0,0,1,0,0|3,0,0]=4 2406 B11R2.988 O=CC1=Cc2ccccc21 Amb24632962 [0,0,0,1,0,0|2,0,1]=4 2407 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [0,0,0,1,0,0|2,0,0]=3 2408 B9R1.12 C=C/C=C/c1ccco1 Amb17939509 [0,0,0,0,1,0|2,0,1]=4 2409 B9R1.12 C=CCCC=1C=CCC1 Amb24596038 [0,0,0,0,1,0|1,0,1]=3 2410 B9R1.12 C=CCC[n]1ccc[n]1 Amb24340287 [0,0,0,0,1,0|3,0,0]=4 2411 B9R1.12 C=CCCc1c[n]c[s]1 Amb24395987 [0,0,0,0,1,0|3,0,0]=4 2412 B9R1.12 C=CCCc1c[s]c[n]1 Amb24102770 [0,0,0,0,1,0|3,0,0]=4 2413 B9R1.12 C=CCCc1ccc[nH]1 Amb25858739 [0,0,0,0,1,0|2,0,0]=3 2414 B9R1.12 C=CCNc1[nH][n]c[n]1 Amb24460793 [0,0,0,0,1,0|3,0,0]=4 2415 B9R1.12 C=CCNc1[n]c[n][s]1 Amb24340284 [0,0,0,0,1,0|3,0,0]=4 2416 B9R1.12 C=CCNc1[n]cc[s]1 Amb18985896 [0,0,0,0,1,0|2,0,0]=3 2417 B9R1.12 C=CCNc1[n]cc[s]1 Amb21954476 [0,0,0,0,1,0|2,0,0]=3 2418 B9R1.12 C=CCNc1[n]cco1 Amb22586361 [0,0,0,0,1,0|2,0,0]=3 2419 B9R1.12 C=CCNc1c[n]co1 Amb25218393 [0,0,0,0,1,0|2,0,0]=3 2420 B9R1.12 C=CCNc1c[s]cc1 Amb25146024 [0,0,0,0,1,0|1,0,0]=2 2421 B9R1.12 C=CCNc1ncco1 Amb2382968 [0,0,0,0,1,0|2,0,0]=3 2422 B9R1.12 C=CCOn1cncc1 Amb2410573 [0,0,0,0,1,0|3,0,0]=4 2423 B9R1.12 C=CCSc1[nH]cc[n]1 Amb25190196 [0,0,0,0,1,0|3,0,0]=4 2424 B9R1.12 C=CCSc1[n]cc[s]1 Amb24101158 [0,0,0,0,1,0|3,0,0]=4 2425 B9R1.12 C=CCSc1ccc[nH]1 Amb24692500 [0,0,0,0,1,0|2,0,0]=3 2426 B9R1.12 C=CCSc1cccs1 Amb17672857 [0,0,0,0,1,0|2,0,0]=3 2427 B9R1.12 C=COCc1ccc[s]1 Amb25337439 [0,0,0,0,1,0|3,0,0]=4 2428 B9R1.12 C=COCc1ccco1 Amb24631898 [0,0,0,0,1,0|3,0,0]=4 2429 B9R1.12 C=CSCc1ccco1 Amb24757008 [0,0,0,0,1,0|3,0,0]=4 2430 B9R1.12 C=C\C=C\c1ccc[nH]1 Amb24514828 [0,0,0,0,1,0|2,0,1]=4 2431 B9R1.12 Cl\C=C\C=C1C=CC=C1 Amb25109347 [0,0,0,0,1,0|2,0,1]=4 2432 B9R1.12 FCCNc1c[s]cc1 Amb24339309 [0,0,0,0,1,0|2,0,1]=4 2433 B9R1.12 N#CCN[n]1cccc1 Amb24383771 [0,0,0,0,1,0|2,0,1]=4 2434 B9R1.12 N#CCNc1ccc[s]1 Amb25318122 [0,0,0,0,1,0|2,0,1]=4 2435 B9R1.12 N#CCNc1cocc1 Amb25068486 [0,0,0,0,1,0|2,0,1]=4 2436 B9R1.12 NCCNc1c[s]cc1 Amb25794987 [0,0,0,0,1,0|2,0,1]=4 2437 B9R1.12 NCCNc1ccc[s]1 Amb18299161 [0,0,0,0,1,0|2,0,1]=4 2438 B9R1.12 O=CCC[n]1cccc1 Amb24062842 [0,0,0,0,1,0|3,0,0]=4 2439 B9R1.12 O=CCCc1ccc[nH]1 Amb24760290 [0,0,0,0,1,0|3,0,0]=4 2440 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,0,0,0,1,0|3,0,0]=4 2441 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,0,0,0,1,0|3,0,0]=4 2442 B9R1.12 O=CCSc1cccs1 Amb17082929 [0,0,0,0,1,0|3,0,0]=4 2443 B9R1.12 OCCN[n]1cccc1 Amb25756597 [0,0,0,0,1,0|2,0,1]=4 2444 B9R1.12 OCCNc1c[nH]cc1 Amb24472507 [0,0,0,0,1,0|2,0,1]=4 2445 B9R1.12 OCCNc1ccc[nH]1 Amb24704389 [0,0,0,0,1,0|2,0,1]=4 2446 B11R1.203 C=CCNC1C=CC=CC=C1 Amb24360765 [0,0,0,0,0,1|0,0,1]=2 2447 B11R1.203 NCCCC1=CNC=CC=C1 Amb25114442 [0,0,0,0,0,1|2,0,1]=4 2448 B11R1.203 OCCOC=1C=CNC=CC1 Amb24069979 [0,0,0,0,0,1|2,0,1]=4 2449 B8R0.1 C=CCNC(=O)NC=C Amb24476626 [1,0,1,0,0,0|2,0,0]=4 2450 B8R0.1 C=C\C=C\C(Br)CC=C Amb24711289 [1,0,1,0,0,0|1,0,1]=4 2451 B8R0.1 C=C\C=C\C(O)CC=C Amb24387710 [1,0,1,0,0,0|1,0,1]=4 2452 B8R0.1 C\C=C\C(=S)NCC=C Amb24643108 [1,0,1,0,0,0|1,0,1]=4 2453 B8R0.4 C=CCNC\C=C\C=C Amb18642152 [1,0,1,0,0,0|0,0,1]=3 2454 B8R0.4 C=CCN\C=N\CC=C Amb24629164 [1,0,1,0,0,0|1,0,1]=4 2455 B8R0.4 C=CC\C=C\C=C/C=O Amb18642058 [1,0,1,0,0,0|1,0,0]=3 2456 B8R0.4 C=CC\C=C\C=CC=O Amb25259279 [1,0,1,0,0,0|1,0,0]=3 2457 B8R0.4 C=CC\C=C\C=C\C=O Amb25772895 [1,0,1,0,0,0|1,0,0]=3 2458 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|0,0,2]=4 2459 B8R0.4 O=C\C=C/C=C\CC=O Amb24496324 [1,0,1,0,0,0|2,0,0]=4 2460 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 2461 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 2462 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 2463 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 2464 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 2465 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 2466 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 2467 B8R1.2 C=C[n+]1ccccc1 Amb10552726 [2,0,0,0,0,0|1,0,0]=3 2468 B8R1.2 C=C[n+]1ccccc1 Amb10552768 [2,0,0,0,0,0|1,0,0]=3 2469 B8R1.2 C=C[n+]1ccccc1 Amb10552769 [2,0,0,0,0,0|1,0,0]=3 2470 B8R1.2 C=C[n+]1ccccc1 Amb10552775 [2,0,0,0,0,0|1,0,0]=3 2471 B8R1.2 C=Cc1[n]ccc[n]1 Amb23411991 [2,0,0,0,0,0|2,0,0]=4 2472 B8R1.2 C=Cc1c[n]c[n]c1 Amb24056355 [2,0,0,0,0,0|2,0,0]=4 2473 B8R1.2 C=Cc1cc[n]c[n]1 Amb24056360 [2,0,0,0,0,0|2,0,0]=4 2474 B8R1.2 C=Cc1ccc[n][n]1 Amb25026421 [2,0,0,0,0,0|2,0,0]=4 2475 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,0]=2 2476 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,0]=2 2477 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,0]=2 2478 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,0]=2 2479 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,0]=2 2480 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,0]=2 2481 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,0]=2 2482 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,0]=2 2483 B8R1.2 C=Cc1cccnc1 Amb10071930 [2,0,0,0,0,0|1,0,0]=3 2484 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|0,0,1]=3 2485 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,1]=4 2486 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,1]=3 2487 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,1]=3 2488 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,1]=3 2489 B8R1.2 CNc1c[n][n]cc1 Amb23560757 [2,0,0,0,0,0|2,0,0]=4 2490 B8R1.2 CNc1c[n]c[n]c1 Amb18268827 [2,0,0,0,0,0|2,0,0]=4 2491 B8R1.2 CNc1c[n]cc[n]1 Amb22292455 [2,0,0,0,0,0|2,0,0]=4 2492 B8R1.2 CNc1cc[n]c[n]1 Amb18944730 [2,0,0,0,0,0|2,0,0]=4 2493 B8R1.2 CNc1ccc[n][n]1 Amb18947507 [2,0,0,0,0,0|2,0,0]=4 2494 B8R1.2 CNc1cnccn1 Amb1102655 [2,0,0,0,0,0|2,0,0]=4 2495 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|1,0,0]=3 2496 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|1,0,0]=3 2497 B8R1.2 CO[n+]1ccccc1 Amb10552605 [2,0,0,0,0,0|2,0,0]=4 2498 B8R1.2 COc1cc[n]cc1 Amb24079672 [2,0,0,0,0,0|2,0,0]=4 2499 B8R1.2 COc1cccnc1 Amb10573360 [2,0,0,0,0,0|2,0,0]=4 2500 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|0,1,0]=3 2501 B8R1.2 CSc1c[n]ccc1 Amb24087396 [2,0,0,0,0,0|2,0,0]=4 2502 B8R1.2 CSc1cc[n]cc1 Amb24103013 [2,0,0,0,0,0|2,0,0]=4 2503 B8R1.2 CSc1cccc[n]1 Amb24081200 [2,0,0,0,0,0|2,0,0]=4 2504 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,1]=3 2505 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|1,0,0]=3 2506 B8R1.2 ClC=C1C=COC=C1 Amb24470181 [2,0,0,0,0,0|2,0,0]=4 2507 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 2508 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 2509 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 2510 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 2511 B8R1.2 ClNc1cccc[n]1 Amb24481501 [2,0,0,0,0,0|2,0,0]=4 2512 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|2,0,0]=4 2513 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 2514 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 2515 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 2516 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 2517 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 2518 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 2519 B8R1.2 FNc1cccc[n]1 Amb25320751 [2,0,0,0,0,0|2,0,0]=4 2520 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|2,0,0]=4 2521 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 2522 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 2523 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 2524 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 2525 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 2526 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 2527 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 2528 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|1,0,1]=4 2529 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|1,0,1]=4 2530 B8R1.2 N=Cc1c[n]ccc1 Amb24062509 [2,0,0,0,0,0|2,0,0]=4 2531 B8R1.2 N=Cc1cccc[n]1 Amb24081259 [2,0,0,0,0,0|2,0,0]=4 2532 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|2,0,0]=4 2533 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|2,0,0]=4 2534 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 2535 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 2536 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|2,0,0]=4 2537 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 2538 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|1,0,0]=3 2539 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|1,0,0]=3 2540 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|1,0,0]=3 2541 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 2542 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 2543 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 2544 B8R1.2 NNc1cc[n]cc1 Amb19893272 [2,0,0,0,0,0|2,0,0]=4 2545 B8R1.2 NNc1cccc[n]1 Amb22494294 [2,0,0,0,0,0|2,0,0]=4 2546 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|1,0,0]=3 2547 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|1,0,0]=3 2548 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|1,0,0]=3 2549 B8R1.2 NNc1ccccn1 Amb1104567 [2,0,0,0,0,0|2,0,0]=4 2550 B8R1.2 NNc1cccnc1 Amb10177783 [2,0,0,0,0,0|2,0,0]=4 2551 B8R1.2 NNc1cccnc1 Amb16192849 [2,0,0,0,0,0|2,0,0]=4 2552 B8R1.2 NNc1cccnc1 Amb2092671 [2,0,0,0,0,0|2,0,0]=4 2553 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 2554 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 2555 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|2,0,0]=4 2556 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|1,0,0]=3 2557 B8R1.2 O=Cc1cc[n]cc1 Amb20672039 [2,0,0,0,0,0|2,0,0]=4 2558 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|1,0,0]=3 2559 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|2,0,0]=4 2560 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|1,0,0]=3 2561 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|2,0,0]=4 2562 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|2,0,0]=4 2563 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|2,0,0]=4 2564 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|2,0,0]=4 2565 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|2,0,0]=4 2566 B8R1.2 ONc1cccc[n]1 Amb25057797 [2,0,0,0,0,0|2,0,0]=4 2567 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 2568 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|1,0,0]=3 2569 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|2,0,0]=4 2570 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|1,0,0]=3 2571 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|1,0,0]=3 2572 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|2,0,0]=4 2573 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|2,0,0]=4 2574 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|2,0,0]=4 2575 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|2,0,0]=4 2576 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,1]=3 2577 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|1,0,0]=3 2578 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 2579 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 2580 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 2581 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|0,0,2]=4 2582 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|2,0,0]=4 2583 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 2584 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|1,0,0]=3 2585 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|2,0,0]=4 2586 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|2,0,0]=4 2587 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|1,0,0]=3 2588 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 2589 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|2,0,0]=4 2590 B10R0.78 OC(=O)\C=C/C(=O)NCC=C Amb2551348 [0,1,1,0,0,0|2,0,0]=4 2591 B10R0.78 OC(=O)\C=C\C(=O)NCC=C Amb1155200 [0,1,1,0,0,0|2,0,0]=4 2592 B10R0.91 C\C=C\C=CC(=O)NCC=C Amb24757739 [0,1,1,0,0,0|1,0,0]=3 2593 B10R0.91 C\C=C\C=C\C(=O)NCC=C Amb25384748 [0,1,1,0,0,0|1,0,0]=3 2594 B10R0.71 O=C\C=C\NC=C\C=C\C=O Amb25179335 [0,1,1,0,0,0|1,0,1]=4 2595 B10R1.1 BrC=Cc1ccc(cc1)Cl Amb17609952 [1,1,0,0,0,0|1,0,1]=4 2596 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,1]=4 2597 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,1]=4 2598 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 2599 B10R1.1 Br\C=C\c1ccc(cc1)Br Amb17609929 [1,1,0,0,0,0|1,0,1]=4 2600 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,1]=4 2601 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 2602 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 2603 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|0,0,2]=4 2604 B10R1.1 C=CCC1C=CC(=O)C=C1 Amb25718380 [1,1,0,0,0,0|0,0,1]=3 2605 B10R1.1 C=CC[n+]1ccc(N)cc1 Amb24486611 [1,1,0,0,0,0|1,0,0]=3 2606 B10R1.1 C=CCc1[n]cc(Br)c[n]1 Amb24679532 [1,1,0,0,0,0|2,0,0]=4 2607 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|0,0,0]=2 2608 B10R1.1 C=CNc1ncc(cn1)N Amb1981393 [1,1,0,0,0,0|2,0,0]=4 2609 B10R1.1 C=COc1ccc(Br)c[n]1 Amb25325808 [1,1,0,0,0,0|2,0,0]=4 2610 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|1,0,0]=3 2611 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|1,0,0]=3 2612 B10R1.1 C=COc1ccc(O)cc1 Amb25134046 [1,1,0,0,0,0|1,0,0]=3 2613 B10R1.1 C=CSc1ccc(Br)c[n]1 Amb25376451 [1,1,0,0,0,0|2,0,0]=4 2614 B10R1.1 C=CSc1ccc(N)cc1 Amb18125327 [1,1,0,0,0,0|1,0,0]=3 2615 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|0,0,2]=4 2616 B10R1.1 CCNC=1C=CC(=O)NC1 Amb24472745 [1,1,0,0,0,0|1,0,1]=4 2617 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [1,1,0,0,0,0|0,0,1]=3 2618 B10R1.1 CCNc1ccc(Cl)[n]c1 Amb24672881 [1,1,0,0,0,0|1,0,1]=4 2619 B10R1.1 CCNc1ccc(F)[n]c1 Amb25073571 [1,1,0,0,0,0|1,0,1]=4 2620 B10R1.1 CCNc1ccc(F)c[n]1 Amb18281102 [1,1,0,0,0,0|1,0,1]=4 2621 B10R1.1 CCNc1ccc(I)c[n]1 Amb24636305 [1,1,0,0,0,0|1,0,1]=4 2622 B10R1.1 CCNc1ccc(N)c[n]1 Amb22295808 [1,1,0,0,0,0|1,0,1]=4 2623 B10R1.1 CCNc1ccc(N)c[n]1 Amb22737072 [1,1,0,0,0,0|1,0,1]=4 2624 B10R1.1 CCNc1ccc(cc1)F Amb1214999 [1,1,0,0,0,0|0,0,1]=3 2625 B10R1.1 CCNc1ccc(cn1)N Amb1117844 [1,1,0,0,0,0|1,0,1]=4 2626 B10R1.1 CCOc1ccc(cc1)N Amb1235495 [1,1,0,0,0,0|1,0,1]=4 2627 B10R1.1 CCOc1ccc(cc1)O Amb1808385 [1,1,0,0,0,0|1,0,1]=4 2628 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [1,1,0,0,0,0|1,0,1]=4 2629 B10R1.1 CCSc1ccc(cc1)N Amb13949222 [1,1,0,0,0,0|1,0,1]=4 2630 B10R1.1 CCSc1ccc(cc1)N Amb2099645 [1,1,0,0,0,0|1,0,1]=4 2631 B10R1.1 CCSc1ccc(cc1)O Amb17202382 [1,1,0,0,0,0|1,0,1]=4 2632 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|1,0,1]=4 2633 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|1,0,1]=4 2634 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|1,0,1]=4 2635 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|1,0,1]=4 2636 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|1,0,1]=4 2637 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|1,0,1]=4 2638 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|1,0,1]=4 2639 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|1,0,1]=4 2640 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|1,0,1]=4 2641 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|1,0,1]=4 2642 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|1,0,1]=4 2643 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|1,0,1]=4 2644 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|1,0,1]=4 2645 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|1,0,1]=4 2646 B10R1.1 CONc1ccc(N)cc1 Amb25823742 [1,1,0,0,0,0|1,0,1]=4 2647 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|1,0,1]=4 2648 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|1,0,1]=4 2649 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|1,0,1]=4 2650 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|1,0,1]=4 2651 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|1,0,1]=4 2652 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb25698766 [1,1,0,0,0,0|0,0,2]=4 2653 B10R1.1 C\C=C\c1ccc(O)cc1 Amb18124423 [1,1,0,0,0,0|0,0,2]=4 2654 B10R1.1 Cc1c[n]c(CC=C)c[n]1 Amb25242584 [1,1,0,0,0,0|2,0,0]=4 2655 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|0,0,2]=4 2656 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,1]=4 2657 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,1]=4 2658 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,1]=4 2659 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 2660 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 2661 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|2,0,0]=4 2662 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 2663 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 2664 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 2665 B10R1.1 Cc1ccc(NC=O)[n]c1 Amb24072528 [1,1,0,0,0,0|2,0,0]=4 2666 B10R1.1 Cc1ccc(OC=C)cc1 Amb17674188 [1,1,0,0,0,0|1,0,0]=3 2667 B10R1.1 Cc1ccc(\C=C\Cl)cc1 Amb24652500 [1,1,0,0,0,0|1,0,1]=4 2668 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|1,0,1]=4 2669 B10R1.1 Cc1ccc(cc1)NC#C Amb24597685 [1,1,0,0,0,0|0,0,2]=4 2670 B10R1.1 Cc1ccc(cc1)NC=S Amb24427648 [1,1,0,0,0,0|1,0,0]=3 2671 B10R1.1 Cc1ccc(cc1)NCO Amb24745213 [1,1,0,0,0,0|1,0,0]=3 2672 B10R1.1 Cc1ccc(cc1)OC=O Amb25248584 [1,1,0,0,0,0|2,0,0]=4 2673 B10R1.1 Cc1ccc(cc1)OCCl Amb24620445 [1,1,0,0,0,0|2,0,0]=4 2674 B10R1.1 Cc1ccc(cc1)PCCl Amb24538070 [1,1,0,0,0,0|1,1,0]=4 2675 B10R1.1 Cc1ccc(cc1)SC=C Amb24375563 [1,1,0,0,0,0|1,0,0]=3 2676 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [1,1,0,0,0,0|2,0,0]=4 2677 B10R1.1 Cl\C=C\c1ccc(cc1)Cl Amb10573154 [1,1,0,0,0,0|1,0,1]=4 2678 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,1]=4 2679 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 2680 B10R1.1 Clc1ccc(\C=C\Br)cc1 Amb25145661 [1,1,0,0,0,0|1,0,1]=4 2681 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|1,0,1]=4 2682 B10R1.1 Clc1ccc(cc1)SCBr Amb24658657 [1,1,0,0,0,0|2,0,0]=4 2683 B10R1.1 Clc1ccc(cc1)SCCl Amb22351380 [1,1,0,0,0,0|2,0,0]=4 2684 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,1]=4 2685 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 2686 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 2687 B10R1.1 Fc1ccc(\C=C\Br)cc1 Amb24553254 [1,1,0,0,0,0|1,0,1]=4 2688 B10R1.1 Fc1ccc(\C=C\Cl)cc1 Amb24482350 [1,1,0,0,0,0|1,0,1]=4 2689 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|1,0,1]=4 2690 B10R1.1 Fc1ccc(cc1)NC=S Amb24703342 [1,1,0,0,0,0|1,0,0]=3 2691 B10R1.1 Fc1ccc(cc1)OCCl Amb24538040 [1,1,0,0,0,0|2,0,0]=4 2692 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|1,0,1]=4 2693 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|1,0,1]=4 2694 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|1,0,1]=4 2695 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|1,0,1]=4 2696 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|1,0,1]=4 2697 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|1,0,1]=4 2698 B10R1.1 N#CNc1ccc(Br)cc1 Amb18330743 [1,1,0,0,0,0|1,0,1]=4 2699 B10R1.1 N#CNc1ccc(F)cc1 Amb20080178 [1,1,0,0,0,0|1,0,1]=4 2700 B10R1.1 N#CNc1ccc(cc1)Cl Amb10071649 [1,1,0,0,0,0|1,0,1]=4 2701 B10R1.1 N#CNc1ccc(cc1)O Amb17593412 [1,1,0,0,0,0|1,0,1]=4 2702 B10R1.1 N=CNc1ccc(Br)c[n]1 Amb25137308 [1,1,0,0,0,0|2,0,0]=4 2703 B10R1.1 N=CNc1ccc(Cl)cc1 Amb25683127 [1,1,0,0,0,0|1,0,0]=3 2704 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,1]=4 2705 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,1]=4 2706 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,1]=4 2707 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,1]=4 2708 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|1,0,1]=4 2709 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|1,0,1]=4 2710 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|1,0,1]=4 2711 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|1,0,1]=4 2712 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|1,0,1]=4 2713 B10R1.1 NCNc1ccc(cc1)C Amb17117016 [1,1,0,0,0,0|1,0,0]=3 2714 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 2715 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 2716 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 2717 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 2718 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 2719 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 2720 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|2,0,0]=4 2721 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|2,0,0]=4 2722 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|2,0,0]=4 2723 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|2,0,0]=4 2724 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|2,0,0]=4 2725 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|2,0,0]=4 2726 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 2727 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 2728 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 2729 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|2,0,0]=4 2730 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|2,0,0]=4 2731 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|2,0,0]=4 2732 B10R1.1 N\C=C\c1ccc(Cl)cc1 Amb24418167 [1,1,0,0,0,0|1,0,1]=4 2733 B10R1.1 Nc1ccc(CC=O)c[n]1 Amb24549097 [1,1,0,0,0,0|2,0,0]=4 2734 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|1,0,0]=3 2735 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,1]=4 2736 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,1]=4 2737 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,1]=4 2738 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|2,0,0]=4 2739 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|2,0,0]=4 2740 B10R1.1 Nc1ccc(cc1)NC#N Amb24585155 [1,1,0,0,0,0|1,0,1]=4 2741 B10R1.1 Nc1ccc(cc1)SC=O Amb25299329 [1,1,0,0,0,0|2,0,0]=4 2742 B10R1.1 Nc1ccc(cc1)SCCl Amb25281595 [1,1,0,0,0,0|2,0,0]=4 2743 B10R1.1 O=CCN1C=CC(=O)C=C1 Amb25337339 [1,1,0,0,0,0|2,0,0]=4 2744 B10R1.1 O=CCc1ccc(Br)[n]c1 Amb24068700 [1,1,0,0,0,0|2,0,0]=4 2745 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|1,0,0]=3 2746 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|1,0,0]=3 2747 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|1,0,0]=3 2748 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|1,0,0]=3 2749 B10R1.1 O=CNc1ccc(Br)[n]c1 Amb24411713 [1,1,0,0,0,0|2,0,0]=4 2750 B10R1.1 O=CNc1ccc(Cl)[n]c1 Amb24480511 [1,1,0,0,0,0|2,0,0]=4 2751 B10R1.1 O=CNc1ccc(F)cc1 Amb20407399 [1,1,0,0,0,0|1,0,0]=3 2752 B10R1.1 O=CNc1ccc(I)c[n]1 Amb25738355 [1,1,0,0,0,0|2,0,0]=4 2753 B10R1.1 O=CNc1ccc(cc1)N Amb17334152 [1,1,0,0,0,0|1,0,0]=3 2754 B10R1.1 O=CNc1ccc(cc1)O Amb2370690 [1,1,0,0,0,0|1,0,0]=3 2755 B10R1.1 O=COc1ccc(Cl)cc1 Amb24436068 [1,1,0,0,0,0|2,0,0]=4 2756 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|1,0,1]=4 2757 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|1,0,1]=4 2758 B10R1.1 OCNc1ccc(Cl)cc1 Amb24702524 [1,1,0,0,0,0|1,0,0]=3 2759 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|2,0,0]=4 2760 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|2,0,0]=4 2761 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|2,0,0]=4 2762 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|2,0,0]=4 2763 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,1]=4 2764 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,1]=4 2765 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,1]=4 2766 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|1,0,1]=4 2767 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|2,0,0]=4 2768 B10R1.1 Oc1ccc(\C=C/Br)cc1 Amb25830036 [1,1,0,0,0,0|1,0,1]=4 2769 B10R1.1 Oc1ccc(cc1)OC=O Amb18643207 [1,1,0,0,0,0|2,0,0]=4 2770 B10R1.1 Oc1ccc(cc1)SCO Amb24631003 [1,1,0,0,0,0|2,0,0]=4 2771 B10R1.1 S=CNc1ccc(Br)cc1 Amb24453374 [1,1,0,0,0,0|1,0,0]=3 2772 B10R1.1 S=CNc1ccc(Cl)cc1 Amb25040558 [1,1,0,0,0,0|1,0,0]=3 2773 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|1,0,1]=4 2774 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|1,0,1]=4 2775 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|1,0,1]=4 2776 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|1,0,1]=4 2777 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,1]=4 2778 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,1]=4 2779 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|2,0,0]=4 2780 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|2,0,0]=4 2781 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|1,0,1]=4 2782 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,1]=4 2783 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,1,0,0,0,0|1,0,1]=4 2784 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,1]=4 2785 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,1]=4 2786 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 2787 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 2788 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|0,0,2]=4 2789 B10R1.4 C=CCC1=CC=CNC1=O Amb24479088 [1,1,0,0,0,0|1,0,0]=3 2790 B10R1.4 C=CCC1=COC=CC1=O Amb22749954 [1,1,0,0,0,0|1,0,0]=3 2791 B10R1.4 C=CCN1C=CC=CC1=O Amb22364461 [1,1,0,0,0,0|1,0,0]=3 2792 B10R1.4 C=CCN1C=CC=CC1=O Amb22730630 [1,1,0,0,0,0|1,0,0]=3 2793 B10R1.4 C=CCN1C=CC=CC1=S Amb24365325 [1,1,0,0,0,0|1,0,0]=3 2794 B10R1.4 C=CCN1C=CC=NC1=O Amb24333903 [1,1,0,0,0,0|2,0,0]=4 2795 B10R1.4 C=CCN1C=CN=CC1=O Amb24583685 [1,1,0,0,0,0|2,0,0]=4 2796 B10R1.4 C=CCN1C=NC=CC1=O Amb24698353 [1,1,0,0,0,0|2,0,0]=4 2797 B10R1.4 C=CCN1N=CC=CC1=O Amb25847497 [1,1,0,0,0,0|2,0,0]=4 2798 B10R1.4 C=CC[n+]1ccccc1Br Amb25854845 [1,1,0,0,0,0|1,0,0]=3 2799 B10R1.4 C=CC[n+]1ccccc1N Amb1394989 [1,1,0,0,0,0|1,0,0]=3 2800 B10R1.4 C=CCc1[n]cccc1O Amb20248276 [1,1,0,0,0,0|1,0,0]=3 2801 B10R1.4 C=CCc1c[n]ccc1Br Amb25167378 [1,1,0,0,0,0|1,0,0]=3 2802 B10R1.4 C=CCc1cc[n]cc1F Amb24524528 [1,1,0,0,0,0|1,0,0]=3 2803 B10R1.4 C=CCc1cccc[n+]1[O-] Amb24433371 [1,1,0,0,0,0|1,0,0]=3 2804 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|0,0,0]=2 2805 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|0,0,0]=2 2806 B10R1.4 C=COc1ccccc1Br Amb25095432 [1,1,0,0,0,0|1,0,0]=3 2807 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|1,0,0]=3 2808 B10R1.4 C=COc1ccccc1O Amb18643057 [1,1,0,0,0,0|1,0,0]=3 2809 B10R1.4 C=CSc1[n]cccc1O Amb18644573 [1,1,0,0,0,0|2,0,0]=4 2810 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|0,0,2]=4 2811 B10R1.4 CCNC1=CC=CNC1=O Amb25063603 [1,1,0,0,0,0|1,0,1]=4 2812 B10R1.4 CCNc1[n]cccc1Br Amb18955277 [1,1,0,0,0,0|1,0,1]=4 2813 B10R1.4 CCNc1[n]cccc1F Amb18963791 [1,1,0,0,0,0|1,0,1]=4 2814 B10R1.4 CCNc1[n]cccc1I Amb24352750 [1,1,0,0,0,0|1,0,1]=4 2815 B10R1.4 CCNc1c[n]ccc1N Amb17933377 [1,1,0,0,0,0|1,0,1]=4 2816 B10R1.4 CCNc1cc[n]cc1Cl Amb25839408 [1,1,0,0,0,0|1,0,1]=4 2817 B10R1.4 CCNc1cc[n]cc1O Amb24744478 [1,1,0,0,0,0|1,0,1]=4 2818 B10R1.4 CCNc1ccc[n]c1N Amb23557979 [1,1,0,0,0,0|1,0,1]=4 2819 B10R1.4 CCNc1ccccc1O Amb18643152 [1,1,0,0,0,0|0,0,1]=3 2820 B10R1.4 CCNc1ccccc1P Amb24563425 [1,1,0,0,0,0|0,0,1]=3 2821 B10R1.4 CCNc1ccccc1S Amb24382138 [1,1,0,0,0,0|0,0,1]=3 2822 B10R1.4 CCNc1ncccc1N Amb10609970 [1,1,0,0,0,0|1,0,1]=4 2823 B10R1.4 CCOc1ccccc1I Amb19888234 [1,1,0,0,0,0|1,0,1]=4 2824 B10R1.4 CCOc1ccccc1N Amb22733118 [1,1,0,0,0,0|1,0,1]=4 2825 B10R1.4 CCOc1ccccc1S Amb20242711 [1,1,0,0,0,0|1,0,1]=4 2826 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,1,0,0,0,0|1,0,1]=4 2827 B10R1.4 CCSc1ccccc1F Amb24480376 [1,1,0,0,0,0|1,0,1]=4 2828 B10R1.4 CCSc1ccccc1N Amb10609429 [1,1,0,0,0,0|1,0,1]=4 2829 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|1,0,1]=4 2830 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|1,0,1]=4 2831 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|1,0,1]=4 2832 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|1,0,1]=4 2833 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|1,0,1]=4 2834 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|1,0,1]=4 2835 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|1,0,1]=4 2836 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|1,0,1]=4 2837 B10R1.4 CNNc1ccccc1Cl Amb22469809 [1,1,0,0,0,0|1,0,1]=4 2838 B10R1.4 CNNc1ccccc1N Amb24654786 [1,1,0,0,0,0|1,0,1]=4 2839 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|1,0,1]=4 2840 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|1,0,1]=4 2841 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|1,0,1]=4 2842 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|1,0,1]=4 2843 B10R1.4 C\C=C/c1ccccc1O Amb24422361 [1,1,0,0,0,0|0,0,2]=4 2844 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|0,0,2]=4 2845 B10R1.4 C\C=C\c1ccccc1N Amb18642929 [1,1,0,0,0,0|0,0,2]=4 2846 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|0,0,2]=4 2847 B10R1.4 C\C=N\c1ccccc1O Amb25296771 [1,1,0,0,0,0|0,0,2]=4 2848 B10R1.4 Cc1[n]cccc1NC=O Amb24072042 [1,1,0,0,0,0|2,0,0]=4 2849 B10R1.4 Cc1c[n]ccc1CC=O Amb25368595 [1,1,0,0,0,0|2,0,0]=4 2850 B10R1.4 Cc1c[n]ccc1NC=O Amb24072215 [1,1,0,0,0,0|2,0,0]=4 2851 B10R1.4 Cc1ccc[n]c1NCC Amb18959725 [1,1,0,0,0,0|1,0,1]=4 2852 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|0,0,2]=4 2853 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,1]=4 2854 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|2,0,0]=4 2855 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|2,0,0]=4 2856 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|1,0,1]=4 2857 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 2858 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 2859 B10R1.4 Cc1ccccc1OC=C Amb17674186 [1,1,0,0,0,0|1,0,0]=3 2860 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,1]=4 2861 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,1]=4 2862 B10R1.4 Cl\C=C\c1ccccc1Cl Amb10572874 [1,1,0,0,0,0|1,0,1]=4 2863 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,1]=4 2864 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 2865 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 2866 B10R1.4 Clc1ccccc1OCCl Amb22227923 [1,1,0,0,0,0|2,0,0]=4 2867 B10R1.4 Clc1ccccc1\C=C\Br Amb24449703 [1,1,0,0,0,0|1,0,1]=4 2868 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,1]=4 2869 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,1]=4 2870 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 2871 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,1,0,0,0,0|2,0,0]=4 2872 B10R1.4 Fc1ccccc1\C=C\Br Amb25141256 [1,1,0,0,0,0|1,0,1]=4 2873 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 2874 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|1,0,1]=4 2875 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 2876 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 2877 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 2878 B10R1.4 N#CNc1ccccc1Br Amb18330738 [1,1,0,0,0,0|1,0,1]=4 2879 B10R1.4 N#CNc1ccccc1Cl Amb10788829 [1,1,0,0,0,0|1,0,1]=4 2880 B10R1.4 N#CNc1ccccc1F Amb20080188 [1,1,0,0,0,0|1,0,1]=4 2881 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,1]=4 2882 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|1,0,1]=4 2883 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,1]=4 2884 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,1]=4 2885 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|1,0,1]=4 2886 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|1,0,1]=4 2887 B10R1.4 NCOc1ccccc1O Amb24502152 [1,1,0,0,0,0|2,0,0]=4 2888 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 2889 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 2890 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|2,0,0]=4 2891 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 2892 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 2893 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 2894 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 2895 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 2896 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|2,0,0]=4 2897 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 2898 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 2899 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 2900 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 2901 B10R1.4 N\C=N\c1ccccc1O Amb18643068 [1,1,0,0,0,0|1,0,1]=4 2902 B10R1.4 Nc1cc[n]cc1CC=O Amb25703380 [1,1,0,0,0,0|2,0,0]=4 2903 B10R1.4 Nc1ccc[n]c1NC=O Amb24072116 [1,1,0,0,0,0|2,0,0]=4 2904 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,1]=4 2905 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,1]=4 2906 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,1]=4 2907 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|1,0,1]=4 2908 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|1,0,1]=4 2909 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|1,0,1]=4 2910 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|2,0,0]=4 2911 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|2,0,0]=4 2912 B10R1.4 Nc1ccccc1NC=O Amb18643067 [1,1,0,0,0,0|1,0,0]=3 2913 B10R1.4 Nc1ccccc1NC=S Amb24390820 [1,1,0,0,0,0|1,0,0]=3 2914 B10R1.4 Nc1ccccc1OCF Amb25112317 [1,1,0,0,0,0|2,0,0]=4 2915 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,1,0,0,0,0|2,0,0]=4 2916 B10R1.4 Nc1ccccc1\C=C\Br Amb25109193 [1,1,0,0,0,0|1,0,1]=4 2917 B10R1.4 Nc1nccc[n+]1CC=C Amb1147314 [1,1,0,0,0,0|2,0,0]=4 2918 B10R1.4 O=CCN1C=CC=CC1=O Amb24059958 [1,1,0,0,0,0|2,0,0]=4 2919 B10R1.4 O=CCN1C=CC=CC1=S Amb24059961 [1,1,0,0,0,0|2,0,0]=4 2920 B10R1.4 O=CCc1cc[n]cc1Cl Amb25250526 [1,1,0,0,0,0|2,0,0]=4 2921 B10R1.4 O=CCc1cc[n]cc1F Amb24553979 [1,1,0,0,0,0|2,0,0]=4 2922 B10R1.4 O=CCc1ccc[n]c1Br Amb24746150 [1,1,0,0,0,0|2,0,0]=4 2923 B10R1.4 O=CCc1ccc[n]c1Cl Amb25768390 [1,1,0,0,0,0|2,0,0]=4 2924 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|1,0,0]=3 2925 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|1,0,0]=3 2926 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|1,0,0]=3 2927 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|1,0,0]=3 2928 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|1,0,0]=3 2929 B10R1.4 O=CNc1cc[n]cc1F Amb24679615 [1,1,0,0,0,0|2,0,0]=4 2930 B10R1.4 O=CNc1ccccc1F Amb24401130 [1,1,0,0,0,0|1,0,0]=3 2931 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|2,0,0]=4 2932 B10R1.4 O=c1[nH]cccc1NC=O Amb24072049 [1,1,0,0,0,0|2,0,0]=4 2933 B10R1.4 O=c1cc[nH]cc1NC=O Amb24072447 [1,1,0,0,0,0|2,0,0]=4 2934 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|1,0,1]=4 2935 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|1,0,1]=4 2936 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|2,0,0]=4 2937 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|2,0,0]=4 2938 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,1]=4 2939 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,1]=4 2940 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,1]=4 2941 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,1]=4 2942 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|1,0,1]=4 2943 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|2,0,0]=4 2944 B10R1.4 Oc1ccccc1OCS Amb25070463 [1,1,0,0,0,0|2,0,0]=4 2945 B10R1.4 Oc1ccccc1\C=C/Cl Amb25774622 [1,1,0,0,0,0|1,0,1]=4 2946 B10R1.4 S=CNc1ccccc1Br Amb25803506 [1,1,0,0,0,0|1,0,0]=3 2947 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|1,0,1]=4 2948 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|1,0,1]=4 2949 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|1,0,1]=4 2950 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|1,0,1]=4 2951 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|1,0,1]=4 2952 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 2953 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|2,0,0]=4 2954 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,1]=4 2955 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 2956 B10R1.10 Brc1cc(\C=C/I)ccc1 Amb22231752 [1,1,0,0,0,0|1,0,1]=4 2957 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,1]=4 2958 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 2959 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 2960 B10R1.10 Brc1cccc(c1)\C=C\Br Amb22831297 [1,1,0,0,0,0|1,0,1]=4 2961 B10R1.10 C=C=Cc1cccc(O)c1 Amb24102484 [1,1,0,0,0,0|0,0,2]=4 2962 B10R1.10 C=CCC1=CC(=O)CC=N1 Amb24662264 [1,1,0,0,0,0|1,0,1]=4 2963 B10R1.10 C=CC[n+]1cc(Br)ccc1 Amb25722840 [1,1,0,0,0,0|1,0,0]=3 2964 B10R1.10 C=CC[n+]1cc(O)ccc1 Amb25781445 [1,1,0,0,0,0|1,0,0]=3 2965 B10R1.10 C=CCc1c[n]cc(Cl)c1 Amb25137887 [1,1,0,0,0,0|1,0,0]=3 2966 B10R1.10 C=CCc1c[n]cc(F)c1 Amb25772526 [1,1,0,0,0,0|1,0,0]=3 2967 B10R1.10 C=CCc1cc[n]c(Cl)c1 Amb24101015 [1,1,0,0,0,0|1,0,0]=3 2968 B10R1.10 C=CCc1cccc(Br)[n]1 Amb25363953 [1,1,0,0,0,0|1,0,0]=3 2969 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|0,0,0]=2 2970 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|0,0,0]=2 2971 B10R1.10 C=CNC1=CC=NC(=O)N1 Amb25267831 [1,1,0,0,0,0|2,0,0]=4 2972 B10R1.10 C=COc1c[n]cc(Br)c1 Amb25683509 [1,1,0,0,0,0|2,0,0]=4 2973 B10R1.10 C=COc1c[n]cc(Cl)c1 Amb24638786 [1,1,0,0,0,0|2,0,0]=4 2974 B10R1.10 C=COc1c[n]cc(F)c1 Amb24415498 [1,1,0,0,0,0|2,0,0]=4 2975 B10R1.10 C=COc1cccc(Br)c1 Amb25248086 [1,1,0,0,0,0|1,0,0]=3 2976 B10R1.10 C=COc1cccc(Cl)c1 Amb24092694 [1,1,0,0,0,0|1,0,0]=3 2977 B10R1.10 C=COc1cccc(I)c1 Amb25144604 [1,1,0,0,0,0|1,0,0]=3 2978 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|1,0,0]=3 2979 B10R1.10 C=CSc1c[n]cc(Br)c1 Amb25351559 [1,1,0,0,0,0|2,0,0]=4 2980 B10R1.10 C=CSc1cccc(Br)[n]1 Amb24664689 [1,1,0,0,0,0|2,0,0]=4 2981 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|0,0,2]=4 2982 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|0,0,2]=4 2983 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|0,0,2]=4 2984 B10R1.10 CCNc1c[n]cc(Br)c1 Amb23450116 [1,1,0,0,0,0|1,0,1]=4 2985 B10R1.10 CCNc1c[n]cc(F)c1 Amb25357603 [1,1,0,0,0,0|1,0,1]=4 2986 B10R1.10 CCNc1c[n]cc(N)c1 Amb25331613 [1,1,0,0,0,0|1,0,1]=4 2987 B10R1.10 CCNc1cc(Cl)ccn1 Amb15692076 [1,1,0,0,0,0|1,0,1]=4 2988 B10R1.10 CCNc1cc(F)cc[n]1 Amb24703961 [1,1,0,0,0,0|1,0,1]=4 2989 B10R1.10 CCNc1cc(N)ccn1 Amb17334158 [1,1,0,0,0,0|1,0,1]=4 2990 B10R1.10 CCNc1cc(O)ccc1 Amb22168804 [1,1,0,0,0,0|0,0,1]=3 2991 B10R1.10 CCNc1cc[n]c(Br)c1 Amb24534676 [1,1,0,0,0,0|1,0,1]=4 2992 B10R1.10 CCNc1cc[n]c(F)c1 Amb25107899 [1,1,0,0,0,0|1,0,1]=4 2993 B10R1.10 CCNc1cccc(Br)[n]1 Amb22271124 [1,1,0,0,0,0|1,0,1]=4 2994 B10R1.10 CCNc1cccc(Br)[n]1 Amb22411595 [1,1,0,0,0,0|1,0,1]=4 2995 B10R1.10 CCNc1cccc(Cl)[n]1 Amb21956629 [1,1,0,0,0,0|1,0,1]=4 2996 B10R1.10 CCNc1cccc(F)[n]1 Amb18951804 [1,1,0,0,0,0|1,0,1]=4 2997 B10R1.10 CCNc1cccc(N)[n]1 Amb25147360 [1,1,0,0,0,0|1,0,1]=4 2998 B10R1.10 CCNc1cccc(c1)F Amb10609458 [1,1,0,0,0,0|0,0,1]=3 2999 B10R1.10 CCNc1cccc(n1)C Amb10553057 [1,1,0,0,0,0|1,0,1]=4 3000 B10R1.10 CCNc1ccnc(c1)Cl Amb13952186 [1,1,0,0,0,0|1,0,1]=4 3001 B10R1.10 CCOc1cccc(Cl)c1 Amb20242486 [1,1,0,0,0,0|1,0,1]=4 3002 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [1,1,0,0,0,0|1,0,1]=4 3003 B10R1.10 CCOc1cccc(c1)N Amb1124598 [1,1,0,0,0,0|1,0,1]=4 3004 B10R1.10 CCOc1cccc(c1)S Amb10070967 [1,1,0,0,0,0|1,0,1]=4 3005 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [1,1,0,0,0,0|1,0,1]=4 3006 B10R1.10 CCSc1cccc(I)c1 Amb25162722 [1,1,0,0,0,0|1,0,1]=4 3007 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [1,1,0,0,0,0|1,0,1]=4 3008 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [1,1,0,0,0,0|1,0,1]=4 3009 B10R1.10 CCSc1cccc(c1)Br Amb10067418 [1,1,0,0,0,0|1,0,1]=4 3010 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|1,0,1]=4 3011 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|1,0,1]=4 3012 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|1,0,1]=4 3013 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|1,0,1]=4 3014 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|1,0,1]=4 3015 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|1,0,1]=4 3016 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|1,0,1]=4 3017 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|1,0,1]=4 3018 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|1,0,1]=4 3019 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|1,0,1]=4 3020 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|1,0,1]=4 3021 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|1,0,1]=4 3022 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|1,0,1]=4 3023 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|1,0,1]=4 3024 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|1,0,1]=4 3025 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|1,0,1]=4 3026 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|1,0,1]=4 3027 B10R1.10 C\C=C\c1cccc(O)c1 Amb18124427 [1,1,0,0,0,0|0,0,2]=4 3028 B10R1.10 Cc1c[n]cc(CC=C)[n]1 Amb24517048 [1,1,0,0,0,0|2,0,0]=4 3029 B10R1.10 Cc1c[n]cc(c1)NCC Amb24480940 [1,1,0,0,0,0|1,0,1]=4 3030 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,1]=4 3031 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 3032 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|2,0,0]=4 3033 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 3034 B10R1.10 Cc1cc(NC=N)[n]cc1 Amb24072428 [1,1,0,0,0,0|2,0,0]=4 3035 B10R1.10 Cc1cc(\C=C/Br)ccc1 Amb24737652 [1,1,0,0,0,0|1,0,1]=4 3036 B10R1.10 Cc1cc(c[n]c1)NC=O Amb24643577 [1,1,0,0,0,0|2,0,0]=4 3037 B10R1.10 Cc1cc(cc[n]1)NCC Amb25110541 [1,1,0,0,0,0|1,0,1]=4 3038 B10R1.10 Cc1cc(ccc1)NC=N Amb24548031 [1,1,0,0,0,0|1,0,0]=3 3039 B10R1.10 Cc1cc(ccc1)SCCl Amb24423887 [1,1,0,0,0,0|2,0,0]=4 3040 B10R1.10 Cc1cc[n]c(c1)NCC Amb18283607 [1,1,0,0,0,0|1,0,1]=4 3041 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|0,0,2]=4 3042 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|1,0,1]=4 3043 B10R1.10 Cc1cccc(NC=N)[n]1 Amb25806229 [1,1,0,0,0,0|2,0,0]=4 3044 B10R1.10 Cc1cccc(NCI)[n]1 Amb24679237 [1,1,0,0,0,0|2,0,0]=4 3045 B10R1.10 Cc1cccc(OC=C)c1 Amb17674187 [1,1,0,0,0,0|1,0,0]=3 3046 B10R1.10 Cc1cccc(c1)SCC Amb25328608 [1,1,0,0,0,0|1,0,1]=4 3047 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,1]=4 3048 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [1,1,0,0,0,0|2,0,0]=4 3049 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [1,1,0,0,0,0|2,0,0]=4 3050 B10R1.10 Clc1cc(\C=C\Br)ccc1 Amb25262044 [1,1,0,0,0,0|1,0,1]=4 3051 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,1]=4 3052 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 3053 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 3054 B10R1.10 Clc1cccc(c1)OCCl Amb24482267 [1,1,0,0,0,0|2,0,0]=4 3055 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,1]=4 3056 B10R1.10 Fc1cc(\C=C\I)ccc1 Amb25049507 [1,1,0,0,0,0|1,0,1]=4 3057 B10R1.10 Fc1cc(ccc1)NC=S Amb24695430 [1,1,0,0,0,0|1,0,0]=3 3058 B10R1.10 Fc1cc(ccc1)OCCl Amb24401502 [1,1,0,0,0,0|2,0,0]=4 3059 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 3060 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 3061 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|1,0,1]=4 3062 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|1,0,1]=4 3063 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|1,0,1]=4 3064 B10R1.10 N#CNc1cccc(Br)c1 Amb18330748 [1,1,0,0,0,0|1,0,1]=4 3065 B10R1.10 N#CNc1cccc(Cl)c1 Amb18799443 [1,1,0,0,0,0|1,0,1]=4 3066 B10R1.10 N#CNc1cccc(I)c1 Amb24680270 [1,1,0,0,0,0|1,0,1]=4 3067 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|1,0,1]=4 3068 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|1,0,1]=4 3069 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|1,0,1]=4 3070 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|1,0,1]=4 3071 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|1,0,1]=4 3072 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|1,0,1]=4 3073 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|1,0,1]=4 3074 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 3075 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|2,0,0]=4 3076 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 3077 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 3078 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|2,0,0]=4 3079 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|2,0,0]=4 3080 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|2,0,0]=4 3081 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|2,0,0]=4 3082 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|2,0,0]=4 3083 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|2,0,0]=4 3084 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|2,0,0]=4 3085 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|2,0,0]=4 3088 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|2,0,0]=4 3089 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|2,0,0]=4 3090 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|2,0,0]=4 3091 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 3092 B10R1.10 Nc1cc(CC=O)cc[n]1 Amb25146413 [1,1,0,0,0,0|2,0,0]=4 3093 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|1,0,0]=3 3094 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,1]=4 3095 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|1,0,1]=4 3096 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|1,0,1]=4 3097 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|1,0,1]=4 3098 B10R1.10 O=CCc1cc(Br)cc[n]1 Amb24482134 [1,1,0,0,0,0|2,0,0]=4 3099 B10R1.10 O=CCc1cccc(Br)[n]1 Amb21858958 [1,1,0,0,0,0|2,0,0]=4 3100 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|1,0,0]=3 3101 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|1,0,0]=3 3102 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|1,0,0]=3 3103 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|1,0,0]=3 3104 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|1,0,0]=3 3105 B10R1.10 O=CNc1c[n]cc(Br)c1 Amb24354748 [1,1,0,0,0,0|2,0,0]=4 3106 B10R1.10 O=CNc1c[n]cc(F)c1 Amb24475259 [1,1,0,0,0,0|2,0,0]=4 3107 B10R1.10 O=CNc1cc[n]c(Br)c1 Amb25125305 [1,1,0,0,0,0|2,0,0]=4 3108 B10R1.10 O=CNc1ccc[n+](c1)[O-] Amb10560230 [1,1,0,0,0,0|2,0,0]=4 3109 B10R1.10 O=CNc1cccc(Br)[n]1 Amb24371374 [1,1,0,0,0,0|2,0,0]=4 3110 B10R1.10 O=CNc1cccc(Br)c1 Amb22367295 [1,1,0,0,0,0|1,0,0]=3 3111 B10R1.10 O=CNc1cccc(Cl)[n]1 Amb25805864 [1,1,0,0,0,0|2,0,0]=4 3112 B10R1.10 O=CNc1cccc(F)[n]1 Amb24072627 [1,1,0,0,0,0|2,0,0]=4 3113 B10R1.10 O=CNc1cccc(F)c1 Amb25830595 [1,1,0,0,0,0|1,0,0]=3 3114 B10R1.10 O=CNc1cccc(I)c1 Amb25240204 [1,1,0,0,0,0|1,0,0]=3 3115 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|1,0,1]=4 3116 B10R1.10 OCNc1cccc(Cl)c1 Amb25804223 [1,1,0,0,0,0|1,0,0]=3 3117 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|2,0,0]=4 3118 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|2,0,0]=4 3119 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,1]=4 3120 B10R1.10 Oc1cc(\C=C\Br)ccc1 Amb24518614 [1,1,0,0,0,0|1,0,1]=4 3121 B10R1.10 Oc1cc(\C=C\Cl)ccc1 Amb24686373 [1,1,0,0,0,0|1,0,1]=4 3122 B10R1.10 Oc1cc(ccc1)OC=O Amb18643208 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.10 Oc1cc(ccc1)OCBr Amb24099888 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.10 Oc1cc(ccc1)SCCl Amb24368844 [1,1,0,0,0,0|2,0,0]=4 3125 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|2,0,0]=4 3126 B10R1.10 Oc1cccc(c1)OCO Amb25712897 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|1,0,1]=4 3128 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|1,0,1]=4 3129 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|1,0,1]=4 3130 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|1,0,1]=4 3131 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,1]=4 3132 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|2,0,0]=4 3133 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|2,0,0]=4 3134 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|2,0,0]=4 3135 B10R1.10 [O-][n+]1cc(CC=O)ccc1 Amb24099139 [1,1,0,0,0,0|2,0,0]=4 3136 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,1,0,0,0,0|2,0,0]=4 3137 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,1,0,0,0,0|1,0,1]=4 3138 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,1,0,0,0,0|1,0,1]=4 3139 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|0,0,2]=4 3140 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,1,0,0,0,0|0,0,2]=4 3141 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,1,0,0,0,0|0,0,2]=4 3142 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|0,0,2]=4 3143 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,1,0,0,0,0|0,0,2]=4 3144 B10R1.15 C=CB(O)c1c[n]ccc1 Amb25806197 [1,1,0,0,0,0|2,0,0]=4 3145 B10R1.15 C=CC(=O)c1cc[n]cc1 Amb24482055 [1,1,0,0,0,0|1,0,1]=4 3146 B10R1.15 C=CC(=O)c1ccc[n]c1 Amb25776729 [1,1,0,0,0,0|1,0,1]=4 3147 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [1,1,0,0,0,0|0,0,1]=3 3148 B10R1.15 C=CC(N)c1c[n][n]cc1 Amb24712905 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.15 C=CC(N)c1cc[n]cc1 Amb25789567 [1,1,0,0,0,0|1,0,0]=3 3150 B10R1.15 C=CC(N)c1cccc[n]1 Amb24561652 [1,1,0,0,0,0|1,0,0]=3 3151 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|0,0,0]=2 3152 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|0,0,0]=2 3153 B10R1.15 C=CC(O)c1c[n]cc[n]1 Amb24353873 [1,1,0,0,0,0|2,0,0]=4 3154 B10R1.15 C=CC(O)c1cc[n]c[n]1 Amb24382233 [1,1,0,0,0,0|2,0,0]=4 3155 B10R1.15 C=CC(O)c1cc[n]cc1 Amb24546417 [1,1,0,0,0,0|1,0,0]=3 3156 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|0,0,0]=2 3157 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,1,0,0,0,0|1,0,0]=3 3158 B10R1.15 C=C[C@@H](N)c1c[n]c[n]c1 Amb24453795 [1,1,0,0,0,0|2,0,0]=4 3159 B10R1.15 C=C[C@@H](N)c1c[n]cc[n]1 Amb25111962 [1,1,0,0,0,0|2,0,0]=4 3160 B10R1.15 C=C[C@@H](N)c1cccc[n]1 Amb25146457 [1,1,0,0,0,0|1,0,0]=3 3161 B10R1.15 C=C[C@@H](O)c1c[n]ccc1 Amb25335661 [1,1,0,0,0,0|1,0,0]=3 3162 B10R1.15 C=C[C@@H](O)c1cccc[n]1 Amb25109191 [1,1,0,0,0,0|1,0,0]=3 3163 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|0,0,0]=2 3164 B10R1.15 C=C[C@H](N)c1c[n]c[n]c1 Amb25146246 [1,1,0,0,0,0|2,0,0]=4 3165 B10R1.15 C=C[C@H](N)c1cccc[n]1 Amb25237215 [1,1,0,0,0,0|1,0,0]=3 3166 B10R1.15 C=C[C@H](O)c1cccc[n]1 Amb24105810 [1,1,0,0,0,0|1,0,0]=3 3167 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,1,0,0,0,0|0,0,0]=2 3168 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [1,1,0,0,0,0|1,0,0]=3 3169 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|0,0,2]=4 3170 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [1,1,0,0,0,0|2,0,0]=4 3171 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|1,0,1]=4 3172 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|2,0,0]=4 3173 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,1,0,0,0,0|2,0,0]=4 3175 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,1,0,0,0,0|1,0,1]=4 3176 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,1,0,0,0,0|0,0,2]=4 3177 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [1,1,0,0,0,0|1,0,1]=4 3178 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [1,1,0,0,0,0|1,0,1]=4 3179 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,1,0,0,0,0|1,0,1]=4 3180 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|0,0,2]=4 3181 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,1,0,0,0,0|0,0,2]=4 3182 B10R1.15 CCN(N)c1cccc[n]1 Amb18643189 [1,1,0,0,0,0|1,0,1]=4 3183 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [1,1,0,0,0,0|0,0,1]=3 3184 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [1,1,0,0,0,0|1,0,1]=4 3185 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,1,0,0,0,0|1,0,1]=4 3186 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|0,0,2]=4 3187 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,1,0,0,0,0|0,0,2]=4 3188 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|0,0,2]=4 3189 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [1,1,0,0,0,0|1,0,1]=4 3190 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [1,1,0,0,0,0|1,0,1]=4 3191 B10R1.15 CN(C=O)c1cc[n]cc1 Amb24096778 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [1,1,0,0,0,0|1,0,0]=3 3193 B10R1.15 CN(CO)c1cc[n]cc1 Amb24481124 [1,1,0,0,0,0|2,0,0]=4 3194 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [1,1,0,0,0,0|1,0,0]=3 3195 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,1,0,0,0,0|1,0,1]=4 3196 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|1,0,1]=4 3197 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,1,0,0,0,0|1,0,1]=4 3198 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,1,0,0,0,0|1,0,1]=4 3199 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|1,0,1]=4 3200 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,1,0,0,0,0|1,0,1]=4 3202 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,1,0,0,0,0|1,0,1]=4 3203 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,1,0,0,0,0|1,0,1]=4 3204 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|1,0,0]=3 3205 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,1,0,0,0,0|1,0,1]=4 3206 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,1,0,0,0,0|1,0,1]=4 3207 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|2,0,0]=4 3208 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|2,0,0]=4 3209 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|2,0,0]=4 3210 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|2,0,0]=4 3211 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|1,0,0]=3 3212 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,1,0,0,0,0|1,0,1]=4 3213 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,1,0,0,0,0|2,0,0]=4 3214 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,1,0,0,0,0|2,0,0]=4 3215 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [1,1,0,0,0,0|2,0,0]=4 3216 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [1,1,0,0,0,0|1,0,1]=4 3217 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,1,0,0,0,0|1,0,1]=4 3218 B10R1.15 C\[N+](=C\Cl)\c1ccccc1 Amb24740754 [1,1,0,0,0,0|1,0,1]=4 3219 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,1,0,0,0,0|0,0,2]=4 3220 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,1,0,0,0,0|0,0,0]=2 3221 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,1,0,0,0,0|1,0,1]=4 3222 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,1,0,0,0,0|1,0,1]=4 3223 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [1,1,0,0,0,0|1,1,0]=4 3224 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,1,0,0,0,0|1,0,1]=4 3225 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,1,0,0,0,0|1,0,1]=4 3226 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [1,1,0,0,0,0|2,0,0]=4 3227 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [1,1,0,0,0,0|1,0,1]=4 3228 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,1]=4 3229 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,1,0,0,0,0|2,0,0]=4 3230 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,1,0,0,0,0|1,0,1]=4 3231 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,1,0,0,0,0|1,0,1]=4 3232 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,1,0,0,0,0|1,0,1]=4 3233 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [1,1,0,0,0,0|1,0,1]=4 3234 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [1,1,0,0,0,0|1,0,1]=4 3235 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,1,0,0,0,0|1,0,1]=4 3236 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|1,0,1]=4 3237 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|1,0,1]=4 3238 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,1,0,0,0,0|1,0,1]=4 3239 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|1,0,1]=4 3240 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,1,0,0,0,0|1,0,1]=4 3241 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,1,0,0,0,0|1,0,1]=4 3242 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,1,0,0,0,0|1,0,1]=4 3243 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,1,0,0,0,0|2,0,0]=4 3244 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|2,0,0]=4 3245 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,1,0,0,0,0|1,0,1]=4 3246 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|1,0,1]=4 3247 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|1,0,1]=4 3248 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,1,0,0,0,0|1,0,1]=4 3249 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,1,0,0,0,0|1,0,1]=4 3250 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,1,0,0,0,0|1,0,1]=4 3252 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,1,0,0,0,0|1,0,1]=4 3253 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,1,0,0,0,0|1,0,1]=4 3254 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|1,0,1]=4 3255 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|1,0,1]=4 3256 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,1,0,0,0,0|1,0,1]=4 3257 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,1,0,0,0,0|1,0,1]=4 3258 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,1,0,0,0,0|1,0,1]=4 3259 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,1,0,0,0,0|1,0,1]=4 3260 B10R1.15 NN(c1ccccc1)C#N Amb10552759 [1,1,0,0,0,0|1,0,1]=4 3261 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,1,0,0,0,0|2,0,0]=4 3262 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,1,0,0,0,0|2,0,0]=4 3263 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,1,0,0,0,0|2,0,0]=4 3264 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,1,0,0,0,0|1,0,1]=4 3265 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,1,0,0,0,0|1,0,1]=4 3266 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,1]=4 3267 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,1]=4 3268 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,1,0,0,0,0|1,0,1]=4 3269 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,1,0,0,0,0|1,0,1]=4 3270 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,1,0,0,0,0|1,0,1]=4 3271 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,1,0,0,0,0|1,0,1]=4 3272 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,1,0,0,0,0|1,0,1]=4 3273 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,1,0,0,0,0|1,0,1]=4 3274 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,1,0,0,0,0|1,0,1]=4 3275 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|2,0,0]=4 3276 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [1,1,0,0,0,0|1,0,1]=4 3277 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,1,0,0,0,0|1,0,0]=3 3278 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|1,0,0]=3 3279 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|1,0,0]=3 3280 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,1,0,0,0,0|1,0,0]=3 3281 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,1,0,0,0,0|1,0,0]=3 3282 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [1,1,0,0,0,0|1,1,0]=4 3283 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,1,0,0,0,0|2,0,0]=4 3284 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,1]=4 3285 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|1,0,1]=4 3286 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|1,0,1]=4 3287 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,1,0,0,0,0|1,0,1]=4 3288 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,1,0,0,0,0|1,0,1]=4 3289 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,1,0,0,0,0|1,0,1]=4 3290 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,1,0,0,0,0|1,0,1]=4 3291 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [1,1,0,0,0,0|1,0,0]=3 3292 B10R1.15 ON(N=O)c1ccccc1 Amb17666641 [1,1,0,0,0,0|2,0,0]=4 3293 B10R1.15 ON(N=O)c1ccccc1 Amb22001406 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,1,0,0,0,0|2,0,0]=4 3295 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,1]=4 3296 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,1]=4 3297 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,1,0,0,0,0|1,0,1]=4 3298 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,1,0,0,0,0|0,0,2]=4 3299 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,1]=4 3300 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,1]=4 3301 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [1,1,0,0,0,0|1,0,1]=4 3302 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [1,1,0,0,0,0|1,0,1]=4 3303 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [1,1,0,0,0,0|1,0,1]=4 3304 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,1,0,0,0,0|1,0,1]=4 3305 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,1,0,0,0,0|1,0,1]=4 3307 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [1,1,0,0,0,0|1,0,1]=4 3308 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,1,0,0,0,0|1,0,1]=4 3309 B10R1.18 BrC(Br)[Hg]c1ccccc1 Amb22345487 [1,1,0,0,0,0|2,0,0]=4 3310 B10R1.18 C=C(Cl)C[n+]1ccccc1 Amb24717958 [1,1,0,0,0,0|1,0,0]=3 3311 B10R1.18 C=C(F)Sc1ccccc1 Amb24630548 [1,1,0,0,0,0|1,0,0]=3 3312 B10R1.18 C=C(O)C=C1C=COC=C1 Amb24407180 [1,1,0,0,0,0|1,0,1]=4 3313 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,1,0,0,0,0|1,0,0]=3 3314 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,1,0,0,0,0|0,0,0]=2 3315 B10R1.18 CC(=C)Oc1cccc[n]1 Amb24101320 [1,1,0,0,0,0|2,0,0]=4 3316 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [1,1,0,0,0,0|1,0,1]=4 3317 B10R1.18 CC(=N)Nc1ccc[n]c1 Amb25848009 [1,1,0,0,0,0|1,0,1]=4 3318 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|0,0,1]=3 3319 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,1,0,0,0,0|1,0,1]=4 3320 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [1,1,0,0,0,0|1,0,1]=4 3321 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [1,1,0,0,0,0|1,0,1]=4 3322 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,1,0,0,0,0|1,0,1]=4 3323 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,1,0,0,0,0|1,0,1]=4 3324 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,1,0,0,0,0|0,0,1]=3 3325 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552800 [1,1,0,0,0,0|1,0,1]=4 3326 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552804 [1,1,0,0,0,0|1,0,1]=4 3327 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb22451374 [1,1,0,0,0,0|1,0,1]=4 3328 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb24086636 [1,1,0,0,0,0|1,0,1]=4 3329 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,1,0,0,0,0|1,0,1]=4 3330 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|1,0,1]=4 3331 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,1,0,0,0,0|0,0,1]=3 3332 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,1,0,0,0,0|0,0,2]=4 3333 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,1,0,0,0,0|0,0,2]=4 3334 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [1,1,0,0,0,0|1,0,1]=4 3335 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [1,1,0,0,0,0|1,0,1]=4 3336 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,1,0,0,0,0|0,0,2]=4 3337 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,1,0,0,0,0|0,1,1]=4 3338 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,1,0,0,0,0|0,0,2]=4 3339 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,1,0,0,0,0|0,0,2]=4 3340 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [1,1,0,0,0,0|1,0,1]=4 3341 B10R1.18 CC(Nc1ccccn1)C Amb1104052 [1,1,0,0,0,0|1,0,1]=4 3342 B10R1.18 CC(Nc1cccnc1)C Amb16231494 [1,1,0,0,0,0|1,0,1]=4 3343 B10R1.18 CC(Nc1cccnc1)C Amb2382996 [1,1,0,0,0,0|1,0,1]=4 3344 B10R1.18 CC(Nc1ccncc1)C Amb16231495 [1,1,0,0,0,0|1,0,1]=4 3345 B10R1.18 CC(Nc1ccncc1)C Amb2383009 [1,1,0,0,0,0|1,0,1]=4 3346 B10R1.18 CC(O)Nc1cccc[n]1 Amb24478972 [1,1,0,0,0,0|1,0,1]=4 3347 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [1,1,0,0,0,0|1,0,1]=4 3348 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,0,2]=4 3349 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,1,0,0,0,0|1,0,1]=4 3350 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [1,1,0,0,0,0|1,0,1]=4 3351 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,1]=4 3352 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [1,1,0,0,0,0|0,0,1]=3 3353 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,1,0,0,0,0|0,0,2]=4 3354 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,1,0,0,0,0|0,0,2]=4 3355 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,1,0,0,0,0|0,0,2]=4 3356 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,2]=4 3357 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,1,0,0,0,0|0,0,2]=4 3358 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|0,1,1]=4 3359 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|0,1,1]=4 3360 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,2]=4 3361 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,1,0,0,0,0|2,0,0]=4 3362 B10R1.18 ClB(Cl)Nc1ccccc1 Amb24658709 [1,1,0,0,0,0|2,0,0]=4 3363 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,1,0,0,0,0|1,0,1]=4 3364 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,1]=4 3365 B10R1.18 ClC(Cl)Sc1ccccc1 Amb24389589 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.18 ClC(Cl)[SiH2]c1ccccc1 Amb22167700 [1,1,0,0,0,0|2,0,0]=4 3367 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,1,0,0,0,0|1,0,1]=4 3369 B10R1.18 FC(Sc1ccccc1)F Amb17232315 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.18 F\C(\Br)=C\c1ccccc1 Amb24053589 [1,1,0,0,0,0|1,0,1]=4 3371 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,0]=3 3372 B10R1.18 NC(=N)Cc1cc[n]cc1 Amb22499359 [1,1,0,0,0,0|2,0,0]=4 3373 B10R1.18 NC(=N)Cc1ccc[n]c1 Amb19890175 [1,1,0,0,0,0|2,0,0]=4 3374 B10R1.18 NC(=N)Nc1cc[n]cc1 Amb22752815 [1,1,0,0,0,0|2,0,0]=4 3375 B10R1.18 NC(=N)Nc1cccc[n]1 Amb24098501 [1,1,0,0,0,0|2,0,0]=4 3376 B10R1.18 NC(=N)Nc1cccc[n]1 Amb25751134 [1,1,0,0,0,0|2,0,0]=4 3377 B10R1.18 NC(=N)Nc1ccccc1 Amb20249360 [1,1,0,0,0,0|1,0,0]=3 3378 B10R1.18 NC(=N)Nc1ccccc1 Amb22732584 [1,1,0,0,0,0|1,0,0]=3 3379 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|1,0,0]=3 3382 B10R1.18 NC(=O)Nc1cc[n]cc1 Amb23581130 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [1,1,0,0,0,0|1,0,0]=3 3384 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [1,1,0,0,0,0|2,0,0]=4 3385 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [1,1,0,0,0,0|2,0,0]=4 3386 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|1,0,0]=3 3387 B10R1.18 NC(=S)Nc1ccccn1 Amb1162454 [1,1,0,0,0,0|2,0,0]=4 3388 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,1,0,0,0,0|1,0,0]=3 3389 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|1,0,1]=4 3390 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,1,0,0,0,0|2,0,0]=4 3391 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,1,0,0,0,0|1,0,1]=4 3392 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,1,0,0,0,0|1,0,1]=4 3393 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [1,1,0,0,0,0|2,0,0]=4 3394 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [1,1,0,0,0,0|2,0,0]=4 3395 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [1,1,0,0,0,0|2,0,0]=4 3396 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,1,0,0,0,0|1,0,0]=3 3397 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,1,0,0,0,0|1,0,0]=3 3398 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,1,0,0,0,0|2,0,0]=4 3399 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,1,0,0,0,0|1,0,0]=3 3400 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,1,0,0,0,0|2,0,0]=4 3401 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,1,0,0,0,0|2,0,0]=4 3402 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|2,0,0]=4 3403 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,1,0,0,0,0|2,0,0]=4 3405 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|2,0,0]=4 3406 B10R1.18 OC(=O)Nc1cc[n]cc1 Amb24070647 [1,1,0,0,0,0|2,0,0]=4 3407 B10R1.18 OC(=O)Nc1ccc[n]c1 Amb24102579 [1,1,0,0,0,0|2,0,0]=4 3408 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,1,0,0,0,0|1,0,0]=3 3409 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [1,1,0,0,0,0|2,0,0]=4 3410 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|1,0,0]=3 3411 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [1,1,0,0,0,0|1,0,0]=3 3412 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|1,0,1]=4 3413 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,1,0,0,0,0|1,0,1]=4 3414 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|2,0,0]=4 3415 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,1,0,0,0,0|1,0,0]=3 3416 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,1,0,0,0,0|1,0,0]=3 3417 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,1,0,0,0,0|1,0,0]=3 3418 B10R1.18 S=C(Cl)Cc1cc[n]cc1 Amb24401128 [1,1,0,0,0,0|2,0,0]=4 3419 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,1,0,0,0,0|1,0,0]=3 3420 B10R1.18 SC(=S)Nc1cccc[n]1 Amb25302011 [1,1,0,0,0,0|2,0,0]=4 3421 B10R1.18 SC(=S)Nc1ccncc1 Amb10554331 [1,1,0,0,0,0|2,0,0]=4 3422 B10R1.18 [2H]C([2H])=Cc1ccccc1 Amb22363280 [1,1,0,0,0,0|1,0,1]=4 3423 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [1,1,0,0,0,0|2,0,0]=4 3424 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [1,1,0,0,0,0|2,0,0]=4 3425 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [1,1,0,0,0,0|2,0,0]=4 3426 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [1,1,0,0,0,0|2,0,0]=4 3427 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [1,1,0,0,0,0|2,0,0]=4 3428 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [1,1,0,0,0,0|2,0,0]=4 3429 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|1,0,0]=3 3430 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|1,0,0]=3 3431 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|2,0,0]=4 3432 B10R1.18 [O-][N+](=O)Nc1ccccc1 Amb17939349 [1,1,0,0,0,0|2,0,0]=4 3433 B10R1.11 C=CCC(=O)c1cc[s]c1 Amb18787450 [0,1,0,0,1,0|2,0,0]=4 3434 B10R1.11 C=CCC(=O)c1ccco1 Amb10562220 [0,1,0,0,1,0|2,0,0]=4 3435 B10R1.11 C=CCC(=O)c1cccs1 Amb10574830 [0,1,0,0,1,0|2,0,0]=4 3436 B10R1.11 C=CCC(N)c1c[nH]cc1 Amb24479271 [0,1,0,0,1,0|2,0,0]=4 3437 B10R1.11 C=CCC(N)c1c[s]cc1 Amb18977586 [0,1,0,0,1,0|2,0,0]=4 3438 B10R1.11 C=CCC(N)c1ccc[s]1 Amb18977588 [0,1,0,0,1,0|2,0,0]=4 3439 B10R1.11 C=CCC(N)c1ccco1 Amb18523799 [0,1,0,0,1,0|2,0,0]=4 3440 B10R1.11 C=CCC(N)c1cocc1 Amb22831523 [0,1,0,0,1,0|2,0,0]=4 3441 B10R1.11 C=CCC(O)c1c[s]cc1 Amb18787528 [0,1,0,0,1,0|2,0,0]=4 3442 B10R1.11 C=CCC(O)c1ccc[s]1 Amb18787527 [0,1,0,0,1,0|2,0,0]=4 3443 B10R1.11 C=CCC(O)c1ccco1 Amb22360627 [0,1,0,0,1,0|2,0,0]=4 3444 B10R1.11 C=CCC(O)c1cocc1 Amb25146242 [0,1,0,0,1,0|2,0,0]=4 3445 B10R1.11 C=CC[C@@H](N)c1c[nH]cc1 Amb25145502 [0,1,0,0,1,0|2,0,0]=4 3446 B10R1.11 C=CC[C@@H](N)c1ccc[s]1 Amb22831180 [0,1,0,0,1,0|2,0,0]=4 3447 B10R1.11 C=CC[C@@H](N)c1ccco1 Amb22831172 [0,1,0,0,1,0|2,0,0]=4 3448 B10R1.11 C=CC[C@H](N)c1c[nH]cc1 Amb24384071 [0,1,0,0,1,0|2,0,0]=4 3449 B10R1.11 C=CC[C@H](N)c1c[s]cc1 Amb24671327 [0,1,0,0,1,0|2,0,0]=4 3450 B10R1.11 C=CC[C@H](N)c1ccc[s]1 Amb24460365 [0,1,0,0,1,0|2,0,0]=4 3451 B10R1.11 C=CC[C@H](N)c1ccco1 Amb25146251 [0,1,0,0,1,0|2,0,0]=4 3452 B10R1.11 C=CC[C@H](N)c1cocc1 Amb24455737 [0,1,0,0,1,0|2,0,0]=4 3453 B10R1.11 CC(CC=C)[n]1cccc1 Amb25268830 [0,1,0,0,1,0|2,0,0]=4 3454 B10R1.11 CC(CC=C)c1ccc[s]1 Amb24480842 [0,1,0,0,1,0|2,0,0]=4 3455 B10R1.16 C=CCCc1ccc(Br)[s]1 Amb25102209 [0,1,0,0,1,0|2,0,0]=4 3456 B10R1.16 C=CCCc1ccc(Br)o1 Amb25093846 [0,1,0,0,1,0|2,0,0]=4 3457 B10R1.16 C=CCCc1ccc(Cl)[s]1 Amb25203220 [0,1,0,0,1,0|2,0,0]=4 3458 B10R1.16 C=CCNc1[n]c(O)c[s]1 Amb24099824 [0,1,0,0,1,0|2,0,0]=4 3459 B10R1.16 C=CCNc1c[s]c(Cl)[n]1 Amb25052906 [0,1,0,0,1,0|2,0,0]=4 3460 B10R1.16 C=CCSc1ccc(Cl)[s]1 Amb25364523 [0,1,0,0,1,0|2,0,0]=4 3461 B10R1.16 Cc1c[s]c(NCC=C)[n]1 Amb18986208 [0,1,0,0,1,0|2,0,0]=4 3462 B10R1.16 Cc1cc(NCC=C)[n]o1 Amb25119358 [0,1,0,0,1,0|2,0,0]=4 3463 B10R1.16 Cc1cc(co1)SCC=C Amb25325196 [0,1,0,0,1,0|2,0,0]=4 3464 B10R1.16 Cc1ccc(CCC=C)[nH]1 Amb24478350 [0,1,0,0,1,0|2,0,0]=4 3465 B10R1.16 Cc1ccc(CCC=C)o1 Amb22339450 [0,1,0,0,1,0|2,0,0]=4 3466 B10R1.16 Cc1coc(NCC=C)[n]1 Amb24680993 [0,1,0,0,1,0|2,0,0]=4 3467 B10R1.21 C=CCCCc1c[nH]cc1 Amb24477245 [0,1,0,0,1,0|2,0,0]=4 3468 B10R1.21 C=CCCSc1ccc[s]1 Amb24482772 [0,1,0,0,1,0|2,0,0]=4 3469 B10R1.21 C=CCNCc1[nH]cc[n]1 Amb18307676 [0,1,0,0,1,0|2,0,0]=4 3470 B10R1.21 C=CCNCc1c[nH]c[n]1 Amb18314168 [0,1,0,0,1,0|2,0,0]=4 3471 B10R1.21 C=CCNCc1c[n]c[s]1 Amb19030205 [0,1,0,0,1,0|2,0,0]=4 3472 B10R1.21 C=CCNCc1c[n]co1 Amb25215962 [0,1,0,0,1,0|2,0,0]=4 3473 B10R1.21 C=CCNCc1c[s]c[n]1 Amb18305311 [0,1,0,0,1,0|2,0,0]=4 3474 B10R1.21 C=CCNCc1cc[n]o1 Amb25071049 [0,1,0,0,1,0|2,0,0]=4 3475 B10R1.21 C=CCNCc1ccc[s]1 Amb19890259 [0,1,0,0,1,0|1,0,0]=3 3476 B10R1.21 C=CCNCc1ccco1 Amb19890257 [0,1,0,0,1,0|1,0,0]=3 3477 B10R1.21 C=CCNCc1cccs1 Amb1153881 [0,1,0,0,1,0|1,0,0]=3 3478 B10R1.21 C=CCNCc1cco[n]1 Amb18643260 [0,1,0,0,1,0|2,0,0]=4 3479 B10R1.21 C=CCNCc1cocc1 Amb25304584 [0,1,0,0,1,0|1,0,0]=3 3480 B10R1.21 C=CCNCc1nccs1 Amb17334368 [0,1,0,0,1,0|2,0,0]=4 3481 B10R1.21 C=CC\N=C\c1ccc[nH]1 Amb25698165 [0,1,0,0,1,0|1,0,1]=4 3482 B10R1.21 C\C=C\CN[n]1cccc1 Amb25719842 [0,1,0,0,1,0|1,0,0]=3 3483 B10R1.21 C\C=C\CNc1c[s]cc1 Amb25336195 [0,1,0,0,1,0|1,0,0]=3 3484 B10R1.21 Cl\C=C\CN[n]1cccc1 Amb25327097 [0,1,0,0,1,0|1,0,0]=3 3485 B10R1.27 C=CC(=O)Nn1cccc1 Amb10554456 [0,1,0,0,1,0|1,0,1]=4 3486 B10R1.27 C=CC(N)Cc1ccc[s]1 Amb24740329 [0,1,0,0,1,0|2,0,0]=4 3487 B10R1.27 C=CC(O)Cc1ccco1 Amb24509496 [0,1,0,0,1,0|2,0,0]=4 3488 B10R1.27 CC(C=C)N[n]1cccc1 Amb25092172 [0,1,0,0,1,0|1,0,0]=3 3489 B10R1.27 CC(C=C)Sc1ccc[s]1 Amb24482855 [0,1,0,0,1,0|2,0,0]=4 3490 B10R1.29 C=CCCc1[s]ccc1Cl Amb25059048 [0,1,0,0,1,0|2,0,0]=4 3491 B10R1.29 C=CCCc1cc[s]c1Br Amb24649113 [0,1,0,0,1,0|2,0,0]=4 3492 B10R1.29 C=CCNc1nccn1C Amb2382948 [0,1,0,0,1,0|2,0,0]=4 3493 B10R1.29 C[n]1cc[n]c1NCC=C Amb22586360 [0,1,0,0,1,0|2,0,0]=4 3494 B10R1.29 Cc1c[s]cc1NCC=C Amb25372014 [0,1,0,0,1,0|1,0,0]=3 3495 B10R1.29 Cc1occc1SCC=C Amb25807207 [0,1,0,0,1,0|2,0,0]=4 3496 B10R1.66 BrC(=C)CSc1cccs1 Amb17939298 [0,1,0,0,1,0|2,0,0]=4 3497 B10R1.66 C=C(Br)CN[n]1cccc1 Amb24623332 [0,1,0,0,1,0|1,0,0]=3 3498 B10R1.66 C=C(Cl)CN[n]1cccc1 Amb24591924 [0,1,0,0,1,0|1,0,0]=3 3499 B10R1.66 NC(=O)CNc1ccc[s]1 Amb25301327 [0,1,0,0,1,0|2,0,0]=4 3500 B10R1.66 OC(=O)CN[n]1cccc1 Amb25042233 [0,1,0,0,1,0|2,0,0]=4 3501 B10R1.66 OC(=O)CNc1cc[s]c1 Amb25322129 [0,1,0,0,1,0|2,0,0]=4 3502 B12R1.18 C=CCOC1=CC=CC=CC1=O Amb25358823 [0,1,0,0,0,1|1,0,0]=3 3503 B12R1.18 C=CCSC1=CC=CC=CC1=O Amb24342038 [0,1,0,0,0,1|1,0,0]=3 3504 B12R1.1 C#CCCNc1ccc(Cl)cc1 Amb25137648 [0,2,0,0,0,0|0,0,2]=4 3505 B12R1.1 C#CCCNc1ccc(I)cc1 Amb24483374 [0,2,0,0,0,0|0,0,2]=4 3506 B12R1.1 C#CCNCc1ccc(Br)cc1 Amb21969141 [0,2,0,0,0,0|0,0,2]=4 3507 B12R1.1 C#CCNCc1ccc(Cl)cc1 Amb21979448 [0,2,0,0,0,0|0,0,2]=4 3508 B12R1.1 C#CCNCc1ccc(cc1)F Amb13951349 [0,2,0,0,0,0|0,0,2]=4 3509 B12R1.1 C=C=C\N=C\c1ccc(O)cc1 Amb24432227 [0,2,0,0,0,0|2,0,0]=4 3510 B12R1.1 C=CCC#Cc1ccc(cc1)Br Amb10571533 [0,2,0,0,0,0|1,0,0]=3 3511 B12R1.1 C=CCCCc1ccc(cc1)C Amb13890670 [0,2,0,0,0,0|1,0,0]=3 3512 B12R1.1 C=CCCCc1ccc(cc1)Cl Amb13890658 [0,2,0,0,0,0|1,0,0]=3 3513 B12R1.1 C=CCCCc1ccc(cc1)F Amb13890682 [0,2,0,0,0,0|1,0,0]=3 3514 B12R1.1 C=CCCNc1[n]cc(F)c[n]1 Amb25130775 [0,2,0,0,0,0|2,0,0]=4 3515 B12R1.1 C=CCCNc1[n]cc(N)c[n]1 Amb24366464 [0,2,0,0,0,0|2,0,0]=4 3516 B12R1.1 C=CCCNc1c[n]c(Br)c[n]1 Amb24723286 [0,2,0,0,0,0|2,0,0]=4 3517 B12R1.1 C=CCCNc1c[n]c(Cl)c[n]1 Amb25250001 [0,2,0,0,0,0|2,0,0]=4 3518 B12R1.1 C=CCCNc1c[n]c(N)c[n]1 Amb24619368 [0,2,0,0,0,0|2,0,0]=4 3519 B12R1.1 C=CCCNc1ccc(Br)cc1 Amb24364913 [0,2,0,0,0,0|0,0,0]=2 3520 B12R1.1 C=CCCNc1ccc(Cl)[n][n]1 Amb25110992 [0,2,0,0,0,0|2,0,0]=4 3521 B12R1.1 C=CCCNc1ccc(F)c[n]1 Amb25792498 [0,2,0,0,0,0|1,0,0]=3 3522 B12R1.1 C=CCCNc1ccc(F)cc1 Amb25152653 [0,2,0,0,0,0|0,0,0]=2 3523 B12R1.1 C=CCCNc1ccc(I)cc1 Amb25087539 [0,2,0,0,0,0|0,0,0]=2 3524 B12R1.1 C=CCCNc1ccc(N)[n][n]1 Amb24698552 [0,2,0,0,0,0|2,0,0]=4 3525 B12R1.1 C=CCCNc1ccc(N)[n]c1 Amb25110991 [0,2,0,0,0,0|1,0,0]=3 3526 B12R1.1 C=CCCNc1ccc(N)c[n]1 Amb25793818 [0,2,0,0,0,0|1,0,0]=3 3527 B12R1.1 C=CCCNc1ccc(N)cc1 Amb24620212 [0,2,0,0,0,0|0,0,0]=2 3528 B12R1.1 C=CCCNc1ccc(cc1)C Amb10559134 [0,2,0,0,0,0|0,0,0]=2 3529 B12R1.1 C=CCCOc1ccc(N)cc1 Amb24102791 [0,2,0,0,0,0|1,0,0]=3 3530 B12R1.1 C=CCNCc1c[n]c(N)[n]c1 Amb23567629 [0,2,0,0,0,0|2,0,0]=4 3531 B12R1.1 C=CCNCc1ccc(O)cc1 Amb19890782 [0,2,0,0,0,0|0,0,0]=2 3532 B12R1.1 C=CCNCc1ccc(cc1)Br Amb1923349 [0,2,0,0,0,0|0,0,0]=2 3533 B12R1.1 C=CCNCc1ccc(cc1)Cl Amb1923348 [0,2,0,0,0,0|0,0,0]=2 3534 B12R1.1 C=CCSCc1ccc(cc1)N Amb17498006 [0,2,0,0,0,0|1,0,0]=3 3535 B12R1.1 C=CC\N=C\c1ccc(F)cc1 Amb24575000 [0,2,0,0,0,0|0,0,1]=3 3536 B12R1.1 C=CC\N=C\c1ccc(O)cc1 Amb25073400 [0,2,0,0,0,0|0,0,1]=3 3537 B12R1.1 C=C\C=C\Cc1ccc(O)cc1 Amb18645358 [0,2,0,0,0,0|1,0,1]=4 3538 B12R1.1 CC#CCNc1ccc(Cl)cc1 Amb18804982 [0,2,0,0,0,0|0,0,2]=4 3539 B12R1.1 CC#CCNc1ccc(F)cc1 Amb18182602 [0,2,0,0,0,0|0,0,2]=4 3540 B12R1.1 CC#CCNc1ccc(I)cc1 Amb24425303 [0,2,0,0,0,0|0,0,2]=4 3541 B12R1.1 CCCNCc1ccc(Br)cc1 Amb19890387 [0,2,0,0,0,0|0,0,2]=4 3542 B12R1.1 CCCNCc1ccc(cc1)C Amb1215690 [0,2,0,0,0,0|0,0,2]=4 3543 B12R1.1 CCCNCc1ccc(cc1)Cl Amb10782093 [0,2,0,0,0,0|0,0,2]=4 3544 B12R1.1 CCCNCc1ccc(cc1)O Amb2445168 [0,2,0,0,0,0|0,0,2]=4 3545 B12R1.1 CCCSNc1ccc(N)cc1 Amb25780327 [0,2,0,0,0,0|0,0,2]=4 3546 B12R1.1 CNCCNc1ccc(Br)cc1 Amb19025288 [0,2,0,0,0,0|0,0,2]=4 3547 B12R1.1 CNCCNc1ccc(Cl)cc1 Amb19025281 [0,2,0,0,0,0|0,0,2]=4 3548 B12R1.1 CNCCNc1ccc(F)cc1 Amb18312613 [0,2,0,0,0,0|0,0,2]=4 3549 B12R1.1 COCCNc1ccc(cc1)N Amb10610074 [0,2,0,0,0,0|0,0,2]=4 3550 B12R1.1 CSCCNc1ccc(Br)cc1 Amb25725440 [0,2,0,0,0,0|0,0,2]=4 3551 B12R1.1 CSCCNc1ccc(F)cc1 Amb18312643 [0,2,0,0,0,0|0,0,2]=4 3552 B12R1.1 CSCCNc1ccc(cc1)C Amb17307505 [0,2,0,0,0,0|0,0,2]=4 3553 B12R1.1 C\C=C\C=N\c1ccc(O)cc1 Amb25347542 [0,2,0,0,0,0|0,0,2]=4 3554 B12R1.1 C\C=C\CNc1c[n]c(N)c[n]1 Amb24647454 [0,2,0,0,0,0|2,0,0]=4 3555 B12R1.1 C\C=C\CNc1ccc(Br)cc1 Amb24344587 [0,2,0,0,0,0|0,0,0]=2 3556 B12R1.1 C\C=C\CNc1ccc(F)cc1 Amb25321448 [0,2,0,0,0,0|0,0,0]=2 3557 B12R1.1 C\C=C\CNc1ccc(I)cc1 Amb25772468 [0,2,0,0,0,0|0,0,0]=2 3558 B12R1.1 C\C=C\CNc1ccc(N)cc1 Amb24578052 [0,2,0,0,0,0|0,0,0]=2 3559 B12R1.1 C\C=C\COc1ccc(Br)c[n]1 Amb25727452 [0,2,0,0,0,0|2,0,0]=4 3560 B12R1.1 C\C=C\COc1ccc(Cl)cc1 Amb24484186 [0,2,0,0,0,0|1,0,0]=3 3561 B12R1.1 C\C=C\COc1ccc(F)cc1 Amb25667089 [0,2,0,0,0,0|1,0,0]=3 3562 B12R1.1 C\C=C\COc1ccc(I)cc1 Amb25755848 [0,2,0,0,0,0|1,0,0]=3 3563 B12R1.1 C\C=C\COc1ccc(N)c[n]1 Amb25128428 [0,2,0,0,0,0|2,0,0]=4 3564 B12R1.1 C\C=C\COc1ccc(N)cc1 Amb18971519 [0,2,0,0,0,0|1,0,0]=3 3565 B12R1.1 C\C=C\CSc1ccc(Br)cc1 Amb25105700 [0,2,0,0,0,0|1,0,0]=3 3566 B12R1.1 C\C=C\CSc1ccc(O)cc1 Amb18796325 [0,2,0,0,0,0|1,0,0]=3 3567 B12R1.1 Cc1ccc(CNCCC)cc1 Amb19890384 [0,2,0,0,0,0|0,0,2]=4 3568 B12R1.1 Cc1ccc(NCCC=C)[n][n]1 Amb24355785 [0,2,0,0,0,0|2,0,0]=4 3569 B12R1.1 Cc1ccc([n]c1)OC\C=C\C Amb25740459 [0,2,0,0,0,0|2,0,0]=4 3570 B12R1.1 Cc1ccc([n]c1)SC\C=C\Cl Amb25334544 [0,2,0,0,0,0|2,0,0]=4 3571 B12R1.1 Cc1ccc(\C=C\C=CCl)cc1 Amb25065319 [0,2,0,0,0,0|1,0,1]=4 3572 B12R1.1 Cc1ccc(\C=C\CC=O)cc1 Amb25259282 [0,2,0,0,0,0|2,0,0]=4 3573 B12R1.1 Cc1ccc(cc1)C#C\C=C\Cl Amb24634236 [0,2,0,0,0,0|1,0,1]=4 3574 B12R1.1 Cc1ccc(cc1)NCC#CC Amb21953778 [0,2,0,0,0,0|0,0,2]=4 3575 B12R1.1 Cc1ccc(cc1)NCCCCl Amb24443028 [0,2,0,0,0,0|0,0,2]=4 3576 B12R1.1 Cc1ccc(cc1)NCCNC Amb19025280 [0,2,0,0,0,0|0,0,2]=4 3577 B12R1.1 Cc1ccc(cc1)NC\C=C\Cl Amb25772558 [0,2,0,0,0,0|0,0,0]=2 3578 B12R1.1 Cc1ccc(cc1)N\C=C\C#N Amb25685344 [0,2,0,0,0,0|0,0,2]=4 3579 B12R1.1 Cc1ccc(cc1)N\C=C\C=O Amb18645504 [0,2,0,0,0,0|0,0,1]=3 3580 B12R1.1 Cc1ccc(cc1)N\N=C\C#N Amb24621416 [0,2,0,0,0,0|1,0,1]=4 3581 B12R1.1 Cc1ccc(cc1)SC\C=C\C Amb25802731 [0,2,0,0,0,0|1,0,0]=3 3582 B12R1.1 ClCCNCc1ccc(cc1)C Amb17335658 [0,2,0,0,0,0|1,0,1]=4 3583 B12R1.1 ClCNCNc1ccc(cc1)I Amb16224771 [0,2,0,0,0,0|1,0,1]=4 3584 B12R1.1 Cl\C=C\CNc1ccc(Br)cc1 Amb24434354 [0,2,0,0,0,0|0,0,0]=2 3585 B12R1.1 Cl\C=C\COc1ccc(Br)[n]c1 Amb25735545 [0,2,0,0,0,0|2,0,0]=4 3586 B12R1.1 Cl\C=C\CSc1ccc(Br)cc1 Amb24525403 [0,2,0,0,0,0|1,0,0]=3 3587 B12R1.1 Clc1ccc([n]c1)SC\C=C\Cl Amb24721240 [0,2,0,0,0,0|2,0,0]=4 3588 B12R1.1 Clc1ccc(cc1)NCCCCl Amb25780138 [0,2,0,0,0,0|0,0,2]=4 3589 B12R1.1 Clc1ccc(cc1)NC\C=C\Cl Amb24710868 [0,2,0,0,0,0|0,0,0]=2 3590 B12R1.1 Clc1ccc(cc1)SC\C=C\Cl Amb24721239 [0,2,0,0,0,0|1,0,0]=3 3591 B12R1.1 FCCCNc1ccc(Cl)cc1 Amb24452998 [0,2,0,0,0,0|0,0,2]=4 3592 B12R1.1 FCCCNc1ccc(I)cc1 Amb25705819 [0,2,0,0,0,0|0,0,2]=4 3593 B12R1.1 Fc1ccc(cc1)C#C\C=C\Cl Amb24578019 [0,2,0,0,0,0|1,0,1]=4 3594 B12R1.1 Fc1ccc(cc1)NCCCF Amb24669915 [0,2,0,0,0,0|0,0,2]=4 3595 B12R1.1 N#CCCNc1ccc(cc1)Br Amb1149927 [0,2,0,0,0,0|0,0,2]=4 3596 B12R1.1 N#CCCNc1ccc(cc1)C Amb1643630 [0,2,0,0,0,0|0,0,2]=4 3597 B12R1.1 N#CCCNc1ccc(cc1)Cl Amb1647287 [0,2,0,0,0,0|0,0,2]=4 3598 B12R1.1 N#CCCNc1ccc(cc1)F Amb1103894 [0,2,0,0,0,0|0,0,2]=4 3599 B12R1.1 N#CCCNc1ccc(cc1)O Amb17142901 [0,2,0,0,0,0|0,0,2]=4 3600 B12R1.1 N#CCNCc1ccc(Br)cc1 Amb18977451 [0,2,0,0,0,0|1,0,1]=4 3601 B12R1.1 N#CCNCc1ccc(O)cc1 Amb25154257 [0,2,0,0,0,0|1,0,1]=4 3602 B12R1.1 N#CCNCc1ccc(cc1)F Amb2416263 [0,2,0,0,0,0|1,0,1]=4 3603 B12R1.1 N#C\C=C\Nc1ccc(cc1)Cl Amb2421734 [0,2,0,0,0,0|0,0,2]=4 3604 B12R1.1 NCCCNc1ccc(cc1)Br Amb17057730 [0,2,0,0,0,0|0,0,2]=4 3605 B12R1.1 NCCCNc1ccc(cc1)C Amb17057723 [0,2,0,0,0,0|0,0,2]=4 3606 B12R1.1 NCCCNc1ccc(cc1)Cl Amb17057729 [0,2,0,0,0,0|0,0,2]=4 3607 B12R1.1 NCCCNc1ccc(cc1)F Amb17057726 [0,2,0,0,0,0|0,0,2]=4 3608 B12R1.1 NCCNCc1ccc(Br)cc1 Amb19012729 [0,2,0,0,0,0|1,0,1]=4 3609 B12R1.1 NCCNCc1ccc(cc1)Cl Amb10075508 [0,2,0,0,0,0|1,0,1]=4 3610 B12R1.1 NCCNCc1ccc(cc1)F Amb10075507 [0,2,0,0,0,0|1,0,1]=4 3611 B12R1.1 N\N=C\CCc1ccc(F)cc1 Amb25854847 [0,2,0,0,0,0|2,0,0]=4 3612 B12R1.1 Nc1ccc(cc1)OC\C=C\Cl Amb18971517 [0,2,0,0,0,0|1,0,0]=3 3613 B12R1.1 O=CC=C=Cc1ccc(Cl)cc1 Amb24588982 [0,2,0,0,0,0|1,0,1]=4 3614 B12R1.1 O=CCCCc1ccc(cc1)Br Amb17089176 [0,2,0,0,0,0|1,0,1]=4 3615 B12R1.1 O=CCCCc1ccc(cc1)C Amb17089167 [0,2,0,0,0,0|1,0,1]=4 3616 B12R1.1 O=CCCCc1ccc(cc1)Cl Amb17089175 [0,2,0,0,0,0|1,0,1]=4 3617 B12R1.1 O=CCCCc1ccc(cc1)F Amb17089174 [0,2,0,0,0,0|1,0,1]=4 3618 B12R1.1 O=CCCSc1ccc(cc1)Br Amb17082947 [0,2,0,0,0,0|1,0,1]=4 3619 B12R1.1 O=CCCSc1ccc(cc1)C Amb17082944 [0,2,0,0,0,0|1,0,1]=4 3620 B12R1.1 O=CCCSc1ccc(cc1)Cl Amb17082946 [0,2,0,0,0,0|1,0,1]=4 3621 B12R1.1 O=CCCSc1ccc(cc1)F Amb17082945 [0,2,0,0,0,0|1,0,1]=4 3622 B12R1.1 O=CNCCc1ccc(I)cc1 Amb25736857 [0,2,0,0,0,0|2,0,0]=4 3623 B12R1.1 O=CNCSc1ccc(Cl)cc1 Amb24495505 [0,2,0,0,0,0|2,0,0]=4 3624 B12R1.1 O=C\C=C\Cc1ccc(F)cc1 Amb24620104 [0,2,0,0,0,0|1,0,1]=4 3625 B12R1.1 O=C\C=C\Nc1ccc(Cl)cc1 Amb18648566 [0,2,0,0,0,0|0,0,1]=3 3626 B12R1.1 O=C\C=C\Oc1ccc(Cl)cc1 Amb18648700 [0,2,0,0,0,0|1,0,1]=4 3627 B12R1.1 O=C\C=N\Nc1ccc(Cl)cc1 Amb24677868 [0,2,0,0,0,0|1,0,0]=3 3628 B12R1.1 O=C\C=N\Nc1ccc(F)cc1 Amb24372498 [0,2,0,0,0,0|1,0,0]=3 3629 B12R1.1 OCCCNc1ccc(cc1)Br Amb17306798 [0,2,0,0,0,0|0,0,2]=4 3630 B12R1.1 OCCCNc1ccc(cc1)C Amb17306885 [0,2,0,0,0,0|0,0,2]=4 3631 B12R1.1 OCCCNc1ccc(cc1)Cl Amb17307252 [0,2,0,0,0,0|0,0,2]=4 3632 B12R1.1 OCCCNc1ccc(cc1)F Amb17306196 [0,2,0,0,0,0|0,0,2]=4 3633 B12R1.1 OCCCNc1ccc(cc1)I Amb17306250 [0,2,0,0,0,0|0,0,2]=4 3634 B12R1.1 Oc1ccc(CC\C=N\O)cc1 Amb24598916 [0,2,0,0,0,0|2,0,0]=4 3635 B12R1.1 Oc1ccc(cc1)NCCCF Amb22008518 [0,2,0,0,0,0|0,0,2]=4 3636 B12R1.1 Oc1ccc(cc1)SC\C=C\Cl Amb18320089 [0,2,0,0,0,0|1,0,0]=3 3637 B12R1.1 S=CNCCc1ccc(Cl)cc1 Amb24558852 [0,2,0,0,0,0|2,0,0]=4 3638 B12R1.16 C=CCC(=O)c1ccc(Br)c[n]1 Amb25034877 [0,2,0,0,0,0|2,0,0]=4 3639 B12R1.16 C=CCC(=O)c1ccc(F)c[n]1 Amb25734822 [0,2,0,0,0,0|2,0,0]=4 3640 B12R1.16 C=CCC(=O)c1ccc(cc1)Br Amb17343203 [0,2,0,0,0,0|1,0,0]=3 3641 B12R1.16 C=CCC(=O)c1ccc(cc1)C Amb10563159 [0,2,0,0,0,0|1,0,0]=3 3642 B12R1.16 C=CCC(=O)c1ccc(cc1)Cl Amb17335459 [0,2,0,0,0,0|1,0,0]=3 3643 B12R1.16 C=CCC(=O)c1ccc(cc1)F Amb17334601 [0,2,0,0,0,0|1,0,0]=3 3644 B12R1.16 C=CCC(=O)c1ccc(cc1)O Amb17334557 [0,2,0,0,0,0|1,0,0]=3 3645 B12R1.16 C=CCC(Cl)c1ccc(Cl)cc1 Amb25039265 [0,2,0,0,0,0|1,0,0]=3 3646 B12R1.16 C=CCC(N)c1ccc(Br)c[n]1 Amb24483663 [0,2,0,0,0,0|2,0,0]=4 3647 B12R1.16 C=CCC(N)c1ccc(Br)cc1 Amb18977585 [0,2,0,0,0,0|1,0,0]=3 3648 B12R1.16 C=CCC(N)c1ccc(Cl)c[n]1 Amb24487269 [0,2,0,0,0,0|2,0,0]=4 3649 B12R1.16 C=CCC(N)c1ccc(F)c[n]1 Amb25756985 [0,2,0,0,0,0|2,0,0]=4 3650 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,2,0,0,0,0|1,0,0]=3 3651 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb19889920 [0,2,0,0,0,0|1,0,0]=3 3652 B12R1.16 C=CCC(N)c1ccc(N)[n]c1 Amb25324241 [0,2,0,0,0,0|2,0,0]=4 3653 B12R1.16 C=CCC(N)c1ccc(N)c[n]1 Amb25365951 [0,2,0,0,0,0|2,0,0]=4 3654 B12R1.16 C=CCC(N)c1ccc(S)cc1 Amb24744499 [0,2,0,0,0,0|1,0,0]=3 3655 B12R1.16 C=CCC(O)c1ccc(Br)c[n]1 Amb24652707 [0,2,0,0,0,0|2,0,0]=4 3656 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,2,0,0,0,0|1,0,0]=3 3657 B12R1.16 C=CCC(O)c1ccc(I)cc1 Amb24384870 [0,2,0,0,0,0|1,0,0]=3 3658 B12R1.16 C=CCC(O)c1ccc(O)cc1 Amb18646044 [0,2,0,0,0,0|1,0,0]=3 3659 B12R1.16 C=CCC(c1ccc(cc1)Cl)N Amb17226689 [0,2,0,0,0,0|1,0,0]=3 3660 B12R1.16 C=CC[C@@H](N)c1ccc(Br)c[n]1 Amb24578799 [0,2,0,0,0,0|2,0,0]=4 3661 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,2,0,0,0,0|1,0,0]=3 3662 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)c[n]1 Amb24562242 [0,2,0,0,0,0|2,0,0]=4 3663 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)cc1 Amb22831187 [0,2,0,0,0,0|1,0,0]=3 3664 B12R1.16 C=CC[C@@H](N)c1ccc(F)[n]c1 Amb25315545 [0,2,0,0,0,0|2,0,0]=4 3665 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb22831777 [0,2,0,0,0,0|1,0,0]=3 3666 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,2,0,0,0,0|1,0,0]=3 3667 B12R1.16 C=CC[C@@H](N)c1ccc(N)[n]c1 Amb24745602 [0,2,0,0,0,0|2,0,0]=4 3668 B12R1.16 C=CC[C@@H](N)c1ccc(N)c[n]1 Amb25727724 [0,2,0,0,0,0|2,0,0]=4 3669 B12R1.16 C=CC[C@@H](N)c1ccc(O)[n]c1 Amb24488627 [0,2,0,0,0,0|2,0,0]=4 3670 B12R1.16 C=CC[C@@H](N)c1ccc(O)c[n]1 Amb24488529 [0,2,0,0,0,0|2,0,0]=4 3671 B12R1.16 C=CC[C@@H](N)c1ccc(O)cc1 Amb25113869 [0,2,0,0,0,0|1,0,0]=3 3672 B12R1.16 C=CC[C@@H](N)c1ccc(S)cc1 Amb25127949 [0,2,0,0,0,0|1,0,0]=3 3673 B12R1.16 C=CC[C@H](N)c1ccc(Br)cc1 Amb24682606 [0,2,0,0,0,0|1,0,0]=3 3674 B12R1.16 C=CC[C@H](N)c1ccc(Cl)[n]c1 Amb24763766 [0,2,0,0,0,0|2,0,0]=4 3675 B12R1.16 C=CC[C@H](N)c1ccc(Cl)cc1 Amb25698455 [0,2,0,0,0,0|1,0,0]=3 3676 B12R1.16 C=CC[C@H](N)c1ccc(I)c[n]1 Amb24743437 [0,2,0,0,0,0|2,0,0]=4 3677 B12R1.16 C=CC[C@H](N)c1ccc(O)[n]c1 Amb25261512 [0,2,0,0,0,0|2,0,0]=4 3678 B12R1.16 C=CC[C@H](N)c1ccc(O)c[n]1 Amb24763701 [0,2,0,0,0,0|2,0,0]=4 3679 B12R1.16 C=CC[C@H](N)c1ccc(O)cc1 Amb25737463 [0,2,0,0,0,0|1,0,0]=3 3680 B12R1.16 C=CC[C@H](O)c1ccc(Cl)[n]c1 Amb24675535 [0,2,0,0,0,0|2,0,0]=4 3681 B12R1.16 C=CC[C@H](O)c1ccc(Cl)cc1 Amb25114679 [0,2,0,0,0,0|1,0,0]=3 3682 B12R1.16 C=CC[C@H](O)c1ccc(O)cc1 Amb24532744 [0,2,0,0,0,0|1,0,0]=3 3683 B12R1.16 C=CNC(=O)c1ccc(N)cc1 Amb24091301 [0,2,0,0,0,0|2,0,0]=4 3684 B12R1.16 C=COC(=O)c1ccc(O)cc1 Amb18645955 [0,2,0,0,0,0|2,0,0]=4 3685 B12R1.16 CN(CC#C)c1ccc(F)cc1 Amb18792473 [0,2,0,0,0,0|0,0,2]=4 3686 B12R1.16 CN(CC#C)c1ccc(I)cc1 Amb24412869 [0,2,0,0,0,0|0,0,2]=4 3687 B12R1.16 CN(CC#C)c1ccc(N)cc1 Amb24590328 [0,2,0,0,0,0|0,0,2]=4 3688 B12R1.16 CN(CC#C)c1ccc(O)cc1 Amb25669925 [0,2,0,0,0,0|0,0,2]=4 3689 B12R1.16 CN(CC#N)c1ccc(I)cc1 Amb25686737 [0,2,0,0,0,0|1,0,1]=4 3690 B12R1.16 CN(CC=C)c1[n]cc(F)c[n]1 Amb24474651 [0,2,0,0,0,0|2,0,0]=4 3691 B12R1.16 CN(CC=C)c1ccc(F)cc1 Amb24370860 [0,2,0,0,0,0|0,0,0]=2 3692 B12R1.16 CN(CC=C)c1ccc(I)cc1 Amb24541418 [0,2,0,0,0,0|0,0,0]=2 3693 B12R1.16 CN(CC=C)c1ccc(N)[n]c1 Amb24524848 [0,2,0,0,0,0|1,0,0]=3 3694 B12R1.16 CN(CC=O)c1ccc(F)cc1 Amb18788556 [0,2,0,0,0,0|1,0,0]=3 3695 B12R1.16 CN(CCBr)c1ccc(F)cc1 Amb24450490 [0,2,0,0,0,0|1,0,1]=4 3696 B12R1.16 CN(CCCl)c1ccc(O)cc1 Amb25321957 [0,2,0,0,0,0|1,0,1]=4 3697 B12R1.16 CN(CCF)c1ccc(N)cc1 Amb25093879 [0,2,0,0,0,0|1,0,1]=4 3698 B12R1.16 CN(CCI)c1ccc(F)cc1 Amb24555424 [0,2,0,0,0,0|1,0,1]=4 3699 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,2,0,0,0,0|1,0,1]=4 3700 B12R1.16 CN(CCN)c1ccc(O)cc1 Amb18251791 [0,2,0,0,0,0|1,0,1]=4 3701 B12R1.16 CN(CCO)c1ccc(O)cc1 Amb25202702 [0,2,0,0,0,0|1,0,1]=4 3702 B12R1.16 CN(c1ccc(cc1)Br)CC#N Amb17343205 [0,2,0,0,0,0|1,0,1]=4 3703 B12R1.16 CN(c1ccc(cc1)C)CC#N Amb17334503 [0,2,0,0,0,0|1,0,1]=4 3704 B12R1.16 CN(c1ccc(cc1)Cl)CC#N Amb17335465 [0,2,0,0,0,0|1,0,1]=4 3705 B12R1.16 CN(c1ccc(cc1)F)CC#N Amb17334603 [0,2,0,0,0,0|1,0,1]=4 3706 B12R1.16 C[C@H](CC=O)c1ccc(Cl)cc1 Amb25039267 [0,2,0,0,0,0|2,0,0]=4 3707 B12R1.16 Cc1ccc([n]c1)[C@@H](N)CC=C Amb25367292 [0,2,0,0,0,0|2,0,0]=4 3708 B12R1.16 Cc1ccc([n]c1)[C@H](N)CC=C Amb25374019 [0,2,0,0,0,0|2,0,0]=4 3709 B12R1.16 Cc1ccc(c[n]1)C(O)CC=C Amb24640163 [0,2,0,0,0,0|2,0,0]=4 3710 B12R1.16 Cc1ccc(c[n]1)[C@@H](N)CC=C Amb25104808 [0,2,0,0,0,0|2,0,0]=4 3711 B12R1.16 Cc1ccc(c[n]1)[C@H](N)CC=C Amb25800375 [0,2,0,0,0,0|2,0,0]=4 3712 B12R1.16 Cc1ccc(cc1)C(=S)CC=O Amb25667637 [0,2,0,0,0,0|2,0,0]=4 3713 B12R1.16 Cc1ccc(cc1)C(C)CC=C Amb24556400 [0,2,0,0,0,0|1,0,0]=3 3714 B12R1.16 Cc1ccc(cc1)C(C)CC=O Amb18645706 [0,2,0,0,0,0|2,0,0]=4 3715 B12R1.16 Cc1ccc(cc1)C(Cl)CC=C Amb25772787 [0,2,0,0,0,0|1,0,0]=3 3716 B12R1.16 Cc1ccc(cc1)C(N)CC=C Amb18977589 [0,2,0,0,0,0|1,0,0]=3 3717 B12R1.16 Cc1ccc(cc1)C(O)CC=C Amb18177785 [0,2,0,0,0,0|1,0,0]=3 3718 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [0,2,0,0,0,0|2,0,0]=4 3719 B12R1.16 Cc1ccc(cc1)N(C)CC#C Amb18787879 [0,2,0,0,0,0|0,0,2]=4 3720 B12R1.16 Cc1ccc(cc1)N(C)CC=O Amb18788188 [0,2,0,0,0,0|1,0,0]=3 3721 B12R1.16 Cc1ccc(cc1)N(C)CCC Amb25154383 [0,2,0,0,0,0|0,0,2]=4 3722 B12R1.16 Cc1ccc(cc1)N(C)CCF Amb25355436 [0,2,0,0,0,0|1,0,1]=4 3723 B12R1.16 Cc1ccc(cc1)N(C)CCS Amb25858637 [0,2,0,0,0,0|1,0,1]=4 3724 B12R1.16 Cc1ccc(cc1)N(N)CCO Amb25755524 [0,2,0,0,0,0|1,0,1]=4 3725 B12R1.16 Cc1ccc(cc1)N(O)CC#C Amb24096641 [0,2,0,0,0,0|0,0,2]=4 3726 B12R1.16 Cc1ccc(cc1)S(=O)CC=O Amb18129100 [0,2,0,0,0,0|2,0,0]=4 3727 B12R1.16 Cc1ccc(cc1)[C@@H](N)CC=C Amb22831227 [0,2,0,0,0,0|1,0,0]=3 3728 B12R1.16 Cc1ccc(cc1)[C@H](C)CC=O Amb24697433 [0,2,0,0,0,0|2,0,0]=4 3729 B12R1.16 ClCCN(c1ccc(cc1)Br)C Amb17351918 [0,2,0,0,0,0|1,0,1]=4 3730 B12R1.16 ClCCN(c1ccc(cc1)C)C Amb17335672 [0,2,0,0,0,0|1,0,1]=4 3731 B12R1.16 ClCCN(c1ccc(cc1)Cl)C Amb17338057 [0,2,0,0,0,0|1,0,1]=4 3732 B12R1.16 ClCCN(c1ccc(cc1)F)C Amb17335952 [0,2,0,0,0,0|1,0,1]=4 3733 B12R1.16 NCCN(c1ccc(cc1)Br)C Amb17059648 [0,2,0,0,0,0|1,0,1]=4 3734 B12R1.16 NCCN(c1ccc(cc1)C)C Amb13893182 [0,2,0,0,0,0|1,0,1]=4 3735 B12R1.16 NCCN(c1ccc(cc1)Cl)C Amb17059647 [0,2,0,0,0,0|1,0,1]=4 3736 B12R1.16 NCCN(c1ccc(cc1)F)C Amb17059644 [0,2,0,0,0,0|1,0,1]=4 3737 B12R1.16 O=C(CC=O)c1ccc(I)cc1 Amb24748951 [0,2,0,0,0,0|2,0,0]=4 3738 B12R1.16 O=CCS(=O)c1ccc(Cl)cc1 Amb25675894 [0,2,0,0,0,0|2,0,0]=4 3739 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [0,2,0,0,0,0|2,0,0]=4 3740 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [0,2,0,0,0,0|2,0,0]=4 3741 B12R1.16 OCCN(c1ccc(cc1)Br)C Amb17344450 [0,2,0,0,0,0|1,0,1]=4 3742 B12R1.16 OCCN(c1ccc(cc1)C)C Amb17334645 [0,2,0,0,0,0|1,0,1]=4 3743 B12R1.16 OCCN(c1ccc(cc1)Cl)C Amb17335812 [0,2,0,0,0,0|1,0,1]=4 3744 B12R1.16 OCCN(c1ccc(cc1)F)C Amb17334764 [0,2,0,0,0,0|1,0,1]=4 3745 B12R1.21 C=C(Br)CNc1[n]cc(I)c[n]1 Amb25340997 [0,2,0,0,0,0|2,0,0]=4 3746 B12R1.21 C=C(Br)CNc1c[n]c(Br)c[n]1 Amb25099765 [0,2,0,0,0,0|2,0,0]=4 3747 B12R1.21 C=C(Br)CNc1c[n]c(Cl)c[n]1 Amb24578932 [0,2,0,0,0,0|2,0,0]=4 3748 B12R1.21 C=C(Br)CNc1ccc(Br)c[n]1 Amb23666556 [0,2,0,0,0,0|1,0,0]=3 3749 B12R1.21 C=C(Br)CNc1ccc(F)c[n]1 Amb25758422 [0,2,0,0,0,0|1,0,0]=3 3750 B12R1.21 C=C(Br)CNc1ccc(N)c[n]1 Amb25233892 [0,2,0,0,0,0|1,0,0]=3 3751 B12R1.21 C=C(Br)CNc1ccc(N)cc1 Amb24752886 [0,2,0,0,0,0|0,0,0]=2 3752 B12R1.21 C=C(Br)COc1ccc(Cl)cc1 Amb25132088 [0,2,0,0,0,0|1,0,0]=3 3753 B12R1.21 C=C(Br)COc1ccc(F)[n]c1 Amb25760342 [0,2,0,0,0,0|2,0,0]=4 3754 B12R1.21 C=C(Br)COc1ccc(F)cc1 Amb25078502 [0,2,0,0,0,0|1,0,0]=3 3755 B12R1.21 C=C(Br)COc1ccc(N)cc1 Amb18971535 [0,2,0,0,0,0|1,0,0]=3 3756 B12R1.21 C=C(Br)CSc1ccc(Br)c[n]1 Amb24346552 [0,2,0,0,0,0|2,0,0]=4 3757 B12R1.21 C=C(Br)CSc1ccc(Cl)c[n]1 Amb25350125 [0,2,0,0,0,0|2,0,0]=4 3758 B12R1.21 C=C(Br)CSc1ccc(N)[n]c1 Amb18969577 [0,2,0,0,0,0|2,0,0]=4 3759 B12R1.21 C=C(Br)CSc1ccc(N)c[n]1 Amb18969576 [0,2,0,0,0,0|2,0,0]=4 3760 B12R1.21 C=C(Br)CSc1ccc(N)cc1 Amb18969573 [0,2,0,0,0,0|1,0,0]=3 3761 B12R1.21 C=C(Cl)CNc1[n]cc(Br)c[n]1 Amb24492867 [0,2,0,0,0,0|2,0,0]=4 3762 B12R1.21 C=C(Cl)CNc1[n]cc(Cl)c[n]1 Amb24492962 [0,2,0,0,0,0|2,0,0]=4 3763 B12R1.21 C=C(Cl)CNc1[n]cc(F)c[n]1 Amb24724167 [0,2,0,0,0,0|2,0,0]=4 3764 B12R1.21 C=C(Cl)CNc1[n]cc(I)c[n]1 Amb25077661 [0,2,0,0,0,0|2,0,0]=4 3765 B12R1.21 C=C(Cl)CNc1[n]cc(N)c[n]1 Amb25123057 [0,2,0,0,0,0|2,0,0]=4 3766 B12R1.21 C=C(Cl)CNc1c[n]c(N)c[n]1 Amb25034921 [0,2,0,0,0,0|2,0,0]=4 3767 B12R1.21 C=C(Cl)CNc1ccc(Br)c[n]1 Amb24553696 [0,2,0,0,0,0|1,0,0]=3 3768 B12R1.21 C=C(Cl)CNc1ccc(F)c[n]1 Amb24492866 [0,2,0,0,0,0|1,0,0]=3 3769 B12R1.21 C=C(Cl)CNc1ccc(F)cc1 Amb18969175 [0,2,0,0,0,0|0,0,0]=2 3770 B12R1.21 C=C(Cl)CNc1ccc(N)[n][n]1 Amb25383374 [0,2,0,0,0,0|2,0,0]=4 3771 B12R1.21 C=C(Cl)CNc1ccc(N)c[n]1 Amb25751709 [0,2,0,0,0,0|1,0,0]=3 3772 B12R1.21 C=C(Cl)CNc1ccc(N)cc1 Amb24525129 [0,2,0,0,0,0|0,0,0]=2 3773 B12R1.21 C=C(Cl)COc1ccc(Cl)[n]c1 Amb24411704 [0,2,0,0,0,0|2,0,0]=4 3774 B12R1.21 C=C(Cl)COc1ccc(Cl)cc1 Amb24484276 [0,2,0,0,0,0|1,0,0]=3 3775 B12R1.21 C=C(Cl)COc1ccc(F)cc1 Amb25084810 [0,2,0,0,0,0|1,0,0]=3 3776 B12R1.21 C=C(Cl)COc1ccc(N)cc1 Amb18971520 [0,2,0,0,0,0|1,0,0]=3 3777 B12R1.21 C=C(Cl)CSc1ccc(Br)cc1 Amb25728844 [0,2,0,0,0,0|1,0,0]=3 3778 B12R1.21 C=C(Cl)CSc1ccc(Cl)c[n]1 Amb25307350 [0,2,0,0,0,0|2,0,0]=4 3779 B12R1.21 C=C(Cl)CSc1ccc(Cl)cc1 Amb25093380 [0,2,0,0,0,0|1,0,0]=3 3780 B12R1.21 C=C(Cl)CSc1ccc(F)cc1 Amb24644981 [0,2,0,0,0,0|1,0,0]=3 3781 B12R1.21 C=C(Cl)CSc1ccc(O)cc1 Amb18319929 [0,2,0,0,0,0|1,0,0]=3 3782 B12R1.21 C=C(F)COc1ccc(Br)cc1 Amb23570540 [0,2,0,0,0,0|1,0,0]=3 3783 B12R1.21 C=C(F)COc1ccc(N)c[n]1 Amb23570553 [0,2,0,0,0,0|2,0,0]=4 3784 B12R1.21 CC(=C)CNc1[n]cc(Br)c[n]1 Amb24553709 [0,2,0,0,0,0|2,0,0]=4 3785 B12R1.21 CC(=C)CNc1[n]cc(N)c[n]1 Amb25302967 [0,2,0,0,0,0|2,0,0]=4 3786 B12R1.21 CC(=C)CNc1c[n]c(Br)c[n]1 Amb25093880 [0,2,0,0,0,0|2,0,0]=4 3787 B12R1.21 CC(=C)CNc1ccc(Br)c[n]1 Amb25708002 [0,2,0,0,0,0|1,0,0]=3 3788 B12R1.21 CC(=C)CNc1ccc(F)c[n]1 Amb25316689 [0,2,0,0,0,0|1,0,0]=3 3789 B12R1.21 CC(=C)CNc1ccc(N)[n][n]1 Amb25201910 [0,2,0,0,0,0|2,0,0]=4 3790 B12R1.21 CC(=C)CNc1ccc(cc1)Br Amb17306797 [0,2,0,0,0,0|0,0,0]=2 3791 B12R1.21 CC(=C)CNc1ccc(cc1)C Amb17306884 [0,2,0,0,0,0|0,0,0]=2 3792 B12R1.21 CC(=C)CNc1ccc(cc1)Cl Amb17307251 [0,2,0,0,0,0|0,0,0]=2 3793 B12R1.21 CC(=C)CNc1ccc(cc1)F Amb17306195 [0,2,0,0,0,0|0,0,0]=2 3794 B12R1.21 CC(=C)CNc1ccc(cc1)I Amb17306249 [0,2,0,0,0,0|0,0,0]=2 3795 B12R1.21 CC(=C)COc1ccc(Cl)cc1 Amb24367387 [0,2,0,0,0,0|1,0,0]=3 3796 B12R1.21 CC(=C)COc1ccc(I)[n]c1 Amb25107445 [0,2,0,0,0,0|2,0,0]=4 3797 B12R1.21 CC(=C)COc1ccc(cc1)F Amb2444928 [0,2,0,0,0,0|1,0,0]=3 3798 B12R1.21 CC(=C)COc1ccc(cc1)N Amb2081541 [0,2,0,0,0,0|1,0,0]=3 3799 B12R1.21 CC(=C)CSc1ccc(Br)cc1 Amb25051868 [0,2,0,0,0,0|1,0,0]=3 3800 B12R1.21 CC(=C)CSc1ccc(Cl)c[n]1 Amb25822805 [0,2,0,0,0,0|2,0,0]=4 3801 B12R1.21 CC(=C)CSc1ccc(O)cc1 Amb18796319 [0,2,0,0,0,0|1,0,0]=3 3802 B12R1.21 CC(=O)CNc1ccc(Cl)cc1 Amb24729554 [0,2,0,0,0,0|0,0,1]=3 3803 B12R1.21 CC(=O)COc1ccc(O)cc1 Amb18646453 [0,2,0,0,0,0|1,0,1]=4 3804 B12R1.21 CC(=O)COc1ccc(cc1)Br Amb17601394 [0,2,0,0,0,0|1,0,1]=4 3805 B12R1.21 CC(=O)COc1ccc(cc1)Cl Amb1094739 [0,2,0,0,0,0|1,0,1]=4 3806 B12R1.21 CC(=O)COc1ccc(cc1)N Amb17110083 [0,2,0,0,0,0|1,0,1]=4 3807 B12R1.21 CC(=O)NNc1ccc(N)cc1 Amb18646317 [0,2,0,0,0,0|1,0,1]=4 3808 B12R1.21 CC(=O)NNc1ccc(cc1)Br Amb1040272 [0,2,0,0,0,0|1,0,1]=4 3809 B12R1.21 CC(=O)NNc1ccc(cc1)C Amb1040273 [0,2,0,0,0,0|1,0,1]=4 3810 B12R1.21 CC(=O)ONc1ccc(O)cc1 Amb24497023 [0,2,0,0,0,0|1,0,1]=4 3811 B12R1.21 CC(C)=CNc1ccc(Cl)cc1 Amb25691550 [0,2,0,0,0,0|0,0,2]=4 3812 B12R1.21 CC(C)=NNc1ccc(Br)cc1 Amb24363445 [0,2,0,0,0,0|1,0,1]=4 3813 B12R1.21 CC(C)=NNc1ccc(F)cc1 Amb25126734 [0,2,0,0,0,0|1,0,1]=4 3814 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb20669276 [0,2,0,0,0,0|0,0,2]=4 3815 B12R1.21 CC(CNc1ccc(cc1)Br)O Amb17142609 [0,2,0,0,0,0|0,0,2]=4 3816 B12R1.21 CC(CNc1ccc(cc1)C)O Amb17138594 [0,2,0,0,0,0|0,0,2]=4 3817 B12R1.21 CC(CNc1ccc(cc1)Cl)O Amb17139127 [0,2,0,0,0,0|0,0,2]=4 3818 B12R1.21 CC(CNc1ccc(cc1)F)O Amb17138651 [0,2,0,0,0,0|0,0,2]=4 3819 B12R1.21 CC(Cl)CNc1ccc(Cl)cc1 Amb24497324 [0,2,0,0,0,0|0,0,2]=4 3820 B12R1.21 CC(N)CNc1ccc(F)cc1 Amb25237265 [0,2,0,0,0,0|0,0,2]=4 3821 B12R1.21 C[C@@H](O)CNc1ccc(F)cc1 Amb25719811 [0,2,0,0,0,0|0,0,2]=4 3822 B12R1.21 C[C@H](O)CNc1ccc(Br)cc1 Amb25719810 [0,2,0,0,0,0|0,0,2]=4 3823 B12R1.21 Cc1c[n]c(NCC(C)=C)[n]c1 Amb25816574 [0,2,0,0,0,0|2,0,0]=4 3824 B12R1.21 Cc1ccc(CCC(N)=N)cc1 Amb18065466 [0,2,0,0,0,0|2,0,0]=4 3825 B12R1.21 Cc1ccc(NCC(=C)Cl)[n][n]1 Amb25774654 [0,2,0,0,0,0|2,0,0]=4 3826 B12R1.21 Cc1ccc(NCC(=C)Cl)[n]c1 Amb25759975 [0,2,0,0,0,0|1,0,0]=3 3827 B12R1.21 Cc1ccc(NCC(C)=C)[n][n]1 Amb25291327 [0,2,0,0,0,0|2,0,0]=4 3828 B12R1.21 Cc1ccc([n]c1)OCC(=C)Cl Amb25318335 [0,2,0,0,0,0|2,0,0]=4 3829 B12R1.21 Cc1ccc([n]c1)SCC(=C)Cl Amb24720573 [0,2,0,0,0,0|2,0,0]=4 3830 B12R1.21 Cc1ccc(c[n]1)OCC(C)=C Amb25730740 [0,2,0,0,0,0|2,0,0]=4 3831 B12R1.21 Cc1ccc(cc1)NCC(=C)Cl Amb18809687 [0,2,0,0,0,0|0,0,0]=2 3832 B12R1.21 Cc1ccc(cc1)NCC(C)=O Amb25068510 [0,2,0,0,0,0|0,0,1]=3 3833 B12R1.21 Cc1ccc(cc1)NCC(C)N Amb22410806 [0,2,0,0,0,0|0,0,2]=4 3834 B12R1.21 Cc1ccc(cc1)NCC(C)S Amb24365983 [0,2,0,0,0,0|0,0,2]=4 3835 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O Amb24626471 [0,2,0,0,0,0|0,0,2]=4 3836 B12R1.21 Cc1ccc(cc1)NNC(N)=O Amb24585130 [0,2,0,0,0,0|2,0,0]=4 3837 B12R1.21 Cc1ccc(cc1)NOC(C)=O Amb24073550 [0,2,0,0,0,0|1,0,1]=4 3838 B12R1.21 Cc1ccc(cc1)SCC(C)=S Amb24607333 [0,2,0,0,0,0|1,0,1]=4 3839 B12R1.21 Cc1ccc(cc1)SCC(N)=S Amb24552332 [0,2,0,0,0,0|2,0,0]=4 3840 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [0,2,0,0,0,0|2,0,0]=4 3841 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [0,2,0,0,0,0|2,0,0]=4 3842 B12R1.21 ClC(=O)COc1ccc(cc1)Br Amb16186415 [0,2,0,0,0,0|2,0,0]=4 3843 B12R1.21 ClC(=O)COc1ccc(cc1)C Amb10880011 [0,2,0,0,0,0|2,0,0]=4 3844 B12R1.21 ClC(=O)CSc1ccc(cc1)Cl Amb17143821 [0,2,0,0,0,0|2,0,0]=4 3845 B12R1.21 FC(CNc1ccc(cc1)C)F Amb16229928 [0,2,0,0,0,0|1,0,1]=4 3846 B12R1.21 FC(F)CNc1ccc(Cl)cc1 Amb18320422 [0,2,0,0,0,0|1,0,1]=4 3847 B12R1.21 Fc1ccc(cc1)NCC(F)F Amb18795535 [0,2,0,0,0,0|1,0,1]=4 3848 B12R1.21 Fc1ccc(cc1)NN=C(Br)Br Amb25725263 [0,2,0,0,0,0|2,0,0]=4 3849 B12R1.21 N=C(COc1ccc(cc1)F)[NH3+] Amb2434228 [0,2,0,0,0,0|2,0,0]=4 3850 B12R1.21 NC(=N)CCc1ccc(Br)cc1 Amb18571448 [0,2,0,0,0,0|2,0,0]=4 3851 B12R1.21 NC(=N)CCc1ccc(Cl)cc1 Amb18564231 [0,2,0,0,0,0|2,0,0]=4 3852 B12R1.21 NC(=N)CCc1ccc(F)cc1 Amb18563719 [0,2,0,0,0,0|2,0,0]=4 3853 B12R1.21 NC(=N)CCc1ccc(cc1)O Amb13883011 [0,2,0,0,0,0|2,0,0]=4 3854 B12R1.21 NC(=N)COc1ccc(F)cc1 Amb19894602 [0,2,0,0,0,0|2,0,0]=4 3855 B12R1.21 NC(=N)NNc1ccc(F)cc1 Amb24429169 [0,2,0,0,0,0|2,0,0]=4 3856 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [0,2,0,0,0,0|2,0,0]=4 3857 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [0,2,0,0,0,0|2,0,0]=4 3858 B12R1.21 NC(=O)CNc1ccc(F)c[n]1 Amb18291151 [0,2,0,0,0,0|2,0,0]=4 3859 B12R1.21 NC(=O)CNc1ccc(cn1)N Amb1119325 [0,2,0,0,0,0|2,0,0]=4 3860 B12R1.21 NC(=O)COc1ccc(cc1)F Amb2456996 [0,2,0,0,0,0|2,0,0]=4 3861 B12R1.21 NC(=O)COc1ccc(cc1)I Amb173371 [0,2,0,0,0,0|2,0,0]=4 3862 B12R1.21 NC(=O)CSc1ccc(O)cc1 Amb19057102 [0,2,0,0,0,0|2,0,0]=4 3863 B12R1.21 NC(=O)CSc1ccc(cc1)Br Amb1218433 [0,2,0,0,0,0|2,0,0]=4 3864 B12R1.21 NC(=O)CSc1ccc(cc1)Cl Amb1530887 [0,2,0,0,0,0|2,0,0]=4 3865 B12R1.21 NC(=O)CSc1ccc(cc1)F Amb1646201 [0,2,0,0,0,0|2,0,0]=4 3866 B12R1.21 NC(=O)NNc1ccc(Cl)cc1 Amb24504721 [0,2,0,0,0,0|2,0,0]=4 3867 B12R1.21 NC(=O)NNc1ccc(O)cc1 Amb24635768 [0,2,0,0,0,0|2,0,0]=4 3868 B12R1.21 NC(=S)CCc1ccc(cc1)Cl Amb17237061 [0,2,0,0,0,0|2,0,0]=4 3869 B12R1.21 NC(=S)CNc1ccc(cc1)C Amb17233761 [0,2,0,0,0,0|1,0,0]=3 3870 B12R1.21 NC(=S)COc1ccc(cc1)F Amb1106123 [0,2,0,0,0,0|2,0,0]=4 3871 B12R1.21 NC(=S)CSc1ccc(F)cc1 Amb25112981 [0,2,0,0,0,0|2,0,0]=4 3872 B12R1.21 NC(=S)NNc1ccc(Br)cc1 Amb18070591 [0,2,0,0,0,0|2,0,0]=4 3873 B12R1.21 NC(=S)NNc1ccc(O)cc1 Amb25151131 [0,2,0,0,0,0|2,0,0]=4 3874 B12R1.21 Nc1ccc(c[n]1)NCC(O)=O Amb18987715 [0,2,0,0,0,0|2,0,0]=4 3875 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [0,2,0,0,0,0|1,0,0]=3 3876 B12R1.21 Nc1ccc(cc1)NCS(O)=O Amb25732370 [0,2,0,0,0,0|2,0,0]=4 3877 B12R1.21 Nc1ccc(cc1)NNC(N)=O Amb24649955 [0,2,0,0,0,0|2,0,0]=4 3878 B12R1.21 Nc1ccc(cc1)OCC(N)=S Amb25821999 [0,2,0,0,0,0|2,0,0]=4 3879 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [0,2,0,0,0,0|2,0,0]=4 3880 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,2,0,0,0,0|2,0,0]=4 3881 B12R1.21 O=C(Cl)CNc1ccc(Cl)cc1 Amb24537780 [0,2,0,0,0,0|1,0,0]=3 3882 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,2,0,0,0,0|2,0,0]=4 3883 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,2,0,0,0,0|2,0,0]=4 3884 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,2,0,0,0,0|2,0,0]=4 3885 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,2,0,0,0,0|2,0,0]=4 3886 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [0,2,0,0,0,0|1,0,0]=3 3887 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [0,2,0,0,0,0|1,0,0]=3 3888 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [0,2,0,0,0,0|1,0,0]=3 3889 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [0,2,0,0,0,0|1,0,0]=3 3890 B12R1.21 OC(=O)CNc1ccc(cn1)N Amb17041212 [0,2,0,0,0,0|2,0,0]=4 3891 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [0,2,0,0,0,0|2,0,0]=4 3892 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [0,2,0,0,0,0|2,0,0]=4 3893 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [0,2,0,0,0,0|2,0,0]=4 3894 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [0,2,0,0,0,0|2,0,0]=4 3895 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [0,2,0,0,0,0|2,0,0]=4 3896 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [0,2,0,0,0,0|2,0,0]=4 3897 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [0,2,0,0,0,0|2,0,0]=4 3898 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [0,2,0,0,0,0|2,0,0]=4 3899 B12R1.21 Oc1ccc(cc1)NCC(F)F Amb22008480 [0,2,0,0,0,0|1,0,1]=4 3900 B12R1.21 Oc1ccc(cc1)OCC(=O)Cl Amb24467045 [0,2,0,0,0,0|2,0,0]=4 3901 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [0,2,0,0,0,0|2,0,0]=4 3902 B12R1.49 C=CC(=O)Cc1ccc(Br)cc1 Amb25710195 [0,2,0,0,0,0|1,0,1]=4 3903 B12R1.49 C=CC(=O)Cc1ccc(Cl)cc1 Amb25715125 [0,2,0,0,0,0|1,0,1]=4 3904 B12R1.49 C=CC(=O)Nc1ccc(Br)[n]c1 Amb24401306 [0,2,0,0,0,0|1,0,1]=4 3905 B12R1.49 C=CC(=O)Nc1ccc(F)c[n]1 Amb24470472 [0,2,0,0,0,0|1,0,1]=4 3906 B12R1.49 C=CC(=O)Nc1ccc(N)[n]c1 Amb18965477 [0,2,0,0,0,0|1,0,1]=4 3907 B12R1.49 C=CC(=O)Nc1ccc(N)cc1 Amb24483453 [0,2,0,0,0,0|0,0,1]=3 3908 B12R1.49 C=CC(=O)Nc1ccc(cc1)[Hg+] Amb17607706 [0,2,0,0,0,0|0,0,1]=3 3909 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [0,2,0,0,0,0|1,0,1]=4 3910 B12R1.49 C=CC(=O)Oc1ccc(Cl)cc1 Amb17933976 [0,2,0,0,0,0|1,0,1]=4 3911 B12R1.49 C=CC(=O)Oc1ccc(F)cc1 Amb25281891 [0,2,0,0,0,0|1,0,1]=4 3912 B12R1.49 C=CC(Cl)Cc1ccc(Cl)cc1 Amb25318302 [0,2,0,0,0,0|1,0,0]=3 3913 B12R1.49 C=CC(N)Cc1ccc(Br)cc1 Amb25126467 [0,2,0,0,0,0|1,0,0]=3 3914 B12R1.49 C=CC(N)Cc1ccc(Cl)cc1 Amb25148723 [0,2,0,0,0,0|1,0,0]=3 3915 B12R1.49 C=CC(N)Cc1ccc(F)cc1 Amb24695153 [0,2,0,0,0,0|1,0,0]=3 3916 B12R1.49 C=CC(O)Cc1ccc(Br)cc1 Amb24474552 [0,2,0,0,0,0|1,0,0]=3 3917 B12R1.49 C=CC(O)Cc1ccc(Cl)cc1 Amb25686541 [0,2,0,0,0,0|1,0,0]=3 3918 B12R1.49 C=CC(O)Cc1ccc(F)cc1 Amb25832059 [0,2,0,0,0,0|1,0,0]=3 3919 B12R1.49 C=CC(O)Cc1ccc(O)cc1 Amb25735226 [0,2,0,0,0,0|1,0,0]=3 3920 B12R1.49 CC(C#C)Nc1ccc(Br)cc1 Amb25061738 [0,2,0,0,0,0|0,0,2]=4 3921 B12R1.49 CC(C#C)Nc1ccc(Cl)cc1 Amb24595436 [0,2,0,0,0,0|0,0,2]=4 3922 B12R1.49 CC(C#C)Nc1ccc(I)cc1 Amb24475168 [0,2,0,0,0,0|0,0,2]=4 3923 B12R1.49 CC(C#N)Nc1ccc(O)cc1 Amb25667047 [0,2,0,0,0,0|1,0,1]=4 3924 B12R1.49 CC(C=C)Nc1[n]cc(F)c[n]1 Amb24665484 [0,2,0,0,0,0|2,0,0]=4 3925 B12R1.49 CC(C=C)Nc1[n]cc(I)c[n]1 Amb25682154 [0,2,0,0,0,0|2,0,0]=4 3926 B12R1.49 CC(C=C)Nc1c[n]c(Cl)c[n]1 Amb24596656 [0,2,0,0,0,0|2,0,0]=4 3927 B12R1.49 CC(C=C)Nc1ccc(Br)cc1 Amb25049662 [0,2,0,0,0,0|0,0,0]=2 3928 B12R1.49 CC(C=C)Nc1ccc(F)c[n]1 Amb24419523 [0,2,0,0,0,0|1,0,0]=3 3929 B12R1.49 CC(C=C)Nc1ccc(N)[n][n]1 Amb25727493 [0,2,0,0,0,0|2,0,0]=4 3930 B12R1.49 CC(C=C)Nc1ccc(N)[n]c1 Amb25692544 [0,2,0,0,0,0|1,0,0]=3 3931 B12R1.49 CC(C=C)Oc1ccc(Cl)cc1 Amb24484184 [0,2,0,0,0,0|1,0,0]=3 3932 B12R1.49 CC(C=C)Oc1ccc(I)cc1 Amb25137309 [0,2,0,0,0,0|1,0,0]=3 3933 B12R1.49 CC(C=C)Oc1ccc(N)cc1 Amb18990276 [0,2,0,0,0,0|1,0,0]=3 3934 B12R1.49 CC(C=C)Oc1ccc(O)cc1 Amb18798279 [0,2,0,0,0,0|1,0,0]=3 3935 B12R1.49 CC(C=C)Sc1ccc(Cl)cc1 Amb25787821 [0,2,0,0,0,0|1,0,0]=3 3936 B12R1.49 CC(C=C)Sc1ccc(N)[n]c1 Amb18990259 [0,2,0,0,0,0|2,0,0]=4 3937 B12R1.49 CC(C=C)Sc1ccc(N)c[n]1 Amb18990258 [0,2,0,0,0,0|2,0,0]=4 3938 B12R1.49 CC(C=C)Sc1ccc(N)cc1 Amb18990255 [0,2,0,0,0,0|1,0,0]=3 3939 B12R1.49 CC(C=C)Sc1ccc(O)cc1 Amb18796334 [0,2,0,0,0,0|1,0,0]=3 3940 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,2,0,0,0,0|1,0,1]=4 3941 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,2,0,0,0,0|1,0,1]=4 3942 B12R1.49 CC(CO)Nc1ccc(Br)cc1 Amb18290179 [0,2,0,0,0,0|1,0,1]=4 3943 B12R1.49 CC(CO)Nc1ccc(Cl)cc1 Amb18290161 [0,2,0,0,0,0|1,0,1]=4 3944 B12R1.49 CC(CO)Nc1ccc(F)cc1 Amb18290165 [0,2,0,0,0,0|1,0,1]=4 3945 B12R1.49 CC(CO)Nc1ccc(I)cc1 Amb24493605 [0,2,0,0,0,0|1,0,1]=4 3946 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [0,2,0,0,0,0|2,0,0]=4 3947 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [0,2,0,0,0,0|2,0,0]=4 3948 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [0,2,0,0,0,0|2,0,0]=4 3949 B12R1.49 CC(Nc1ccc(cc1)Br)C#N Amb17406666 [0,2,0,0,0,0|1,0,1]=4 3950 B12R1.49 CC(Nc1ccc(cc1)C)C#N Amb17400078 [0,2,0,0,0,0|1,0,1]=4 3951 B12R1.49 CC(Nc1ccc(cc1)Cl)C#N Amb17400853 [0,2,0,0,0,0|1,0,1]=4 3952 B12R1.49 CC(Nc1ccc(cc1)F)C#N Amb17400148 [0,2,0,0,0,0|1,0,1]=4 3953 B12R1.49 CCC(O)Nc1ccc(N)cc1 Amb25774074 [0,2,0,0,0,0|0,0,2]=4 3954 B12R1.49 CN(Cc1ccc(O)cc1)C=C Amb24408917 [0,2,0,0,0,0|2,0,0]=4 3955 B12R1.49 C\C=C(\C)/Nc1ccc(C)cc1 Amb24536767 [0,2,0,0,0,0|0,0,2]=4 3956 B12R1.49 Cc1c[n]c(NC(C)C=C)[n]c1 Amb24355560 [0,2,0,0,0,0|2,0,0]=4 3957 B12R1.49 Cc1ccc(CC(=O)C=C)cc1 Amb25069127 [0,2,0,0,0,0|1,0,1]=4 3958 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,2,0,0,0,0|2,0,0]=4 3959 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [0,2,0,0,0,0|2,0,0]=4 3960 B12R1.49 Cc1ccc(CC(O)C=C)cc1 Amb25845662 [0,2,0,0,0,0|1,0,0]=3 3961 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [0,2,0,0,0,0|2,0,0]=4 3962 B12R1.49 Cc1ccc(NC(C)C=C)[n]c1 Amb25287885 [0,2,0,0,0,0|1,0,0]=3 3963 B12R1.49 Cc1ccc([n]c1)SC(C)C=C Amb24613336 [0,2,0,0,0,0|2,0,0]=4 3964 B12R1.49 Cc1ccc(c[n]1)NC(=O)C=C Amb25119143 [0,2,0,0,0,0|1,0,1]=4 3965 B12R1.49 Cc1ccc(cc1)NC(=O)C=O Amb25690866 [0,2,0,0,0,0|1,0,1]=4 3966 B12R1.49 Cc1ccc(cc1)NC(C)CN Amb18646166 [0,2,0,0,0,0|1,0,1]=4 3967 B12R1.49 Cc1ccc(cc1)NC(C)CO Amb18971798 [0,2,0,0,0,0|1,0,1]=4 3968 B12R1.49 Cc1ccc(cc1)NC(S)NN Amb24351216 [0,2,0,0,0,0|2,0,0]=4 3969 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CC Amb24635875 [0,2,0,0,0,0|0,0,2]=4 3970 B12R1.49 Cc1ccc(cc1)OC(=O)C=C Amb24493128 [0,2,0,0,0,0|1,0,1]=4 3971 B12R1.49 Cc1ccc(cc1)OC(C)C=C Amb24484185 [0,2,0,0,0,0|1,0,0]=3 3972 B12R1.49 Cc1ccc(cc1)SC(C)C=C Amb25153247 [0,2,0,0,0,0|1,0,0]=3 3973 B12R1.49 Cc1ccc(cc1)SC(C)C=O Amb18648416 [0,2,0,0,0,0|2,0,0]=4 3974 B12R1.49 Cc1ccc(cc1)S[C@@H](C)C=O Amb25122785 [0,2,0,0,0,0|2,0,0]=4 3975 B12R1.49 Cc1ccc(cc1)S[C@H](C)C=O Amb25039916 [0,2,0,0,0,0|2,0,0]=4 3976 B12R1.49 NCC(Nc1ccc(cc1)Br)C Amb17226676 [0,2,0,0,0,0|1,0,1]=4 3977 B12R1.49 NNC(S)Nc1ccc(Cl)cc1 Amb25292409 [0,2,0,0,0,0|2,0,0]=4 3978 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [0,2,0,0,0,0|2,0,0]=4 3979 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [0,2,0,0,0,0|2,0,0]=4 3980 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [0,2,0,0,0,0|2,0,0]=4 3981 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [0,2,0,0,0,0|2,0,0]=4 3982 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [0,2,0,0,0,0|2,0,0]=4 3983 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [0,2,0,0,0,0|2,0,0]=4 3984 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [0,2,0,0,0,0|2,0,0]=4 3985 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [0,2,0,0,0,0|2,0,0]=4 3986 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [0,2,0,0,0,0|2,0,0]=4 3987 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [0,2,0,0,0,0|2,0,0]=4 3988 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [0,2,0,0,0,0|2,0,0]=4 3989 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [0,2,0,0,0,0|2,0,0]=4 3990 B12R1.69 C#CCNc1ccc(Br)cc1Br Amb25782501 [0,2,0,0,0,0|0,0,2]=4 3991 B12R1.69 C#CCNc1ccc(Br)cc1F Amb25310911 [0,2,0,0,0,0|0,0,2]=4 3992 B12R1.69 C#CCNc1ccc(Cl)cc1Cl Amb18332625 [0,2,0,0,0,0|0,0,2]=4 3993 B12R1.69 C#CCNc1ccc(Cl)cc1F Amb19074647 [0,2,0,0,0,0|0,0,2]=4 3994 B12R1.69 C#CCNc1ccc(Cl)cc1I Amb25333883 [0,2,0,0,0,0|0,0,2]=4 3995 B12R1.69 C#CCNc1ccc(F)cc1Cl Amb19074648 [0,2,0,0,0,0|0,0,2]=4 3996 B12R1.69 C#CCNc1ccc(F)cc1N Amb25114762 [0,2,0,0,0,0|0,0,2]=4 3997 B12R1.69 C#CCNc1ccc(cc1Br)C Amb17307365 [0,2,0,0,0,0|0,0,2]=4 3998 B12R1.69 C#CCNc1ccc(cc1F)F Amb17307301 [0,2,0,0,0,0|0,0,2]=4 3999 B12R1.69 C=CCCN1C=CC(=O)C=C1Cl Amb25092728 [0,2,0,0,0,0|2,0,0]=4 4000 B12R1.69 C=CCCc1ccc(Br)cc1Cl Amb24692580 [0,2,0,0,0,0|1,0,0]=3 4001 B12R1.69 C=CCCc1ccc(F)cc1Br Amb25766317 [0,2,0,0,0,0|1,0,0]=3 4002 B12R1.69 C=CCNc1[n]cc(Br)cc1Br Amb18891792 [0,2,0,0,0,0|1,0,0]=3 4003 B12R1.69 C=CCNc1[n]cc(Br)cc1Cl Amb18228817 [0,2,0,0,0,0|1,0,0]=3 4004 B12R1.69 C=CCNc1[n]cc(Br)cc1F Amb25368045 [0,2,0,0,0,0|1,0,0]=3 4005 B12R1.69 C=CCNc1[n]cc(N)cc1Cl Amb18863075 [0,2,0,0,0,0|1,0,0]=3 4006 B12R1.69 C=CCNc1[n]cc(N)cc1N Amb25111090 [0,2,0,0,0,0|1,0,0]=3 4007 B12R1.69 C=CCNc1ccc(Br)cc1Cl Amb25189604 [0,2,0,0,0,0|0,0,0]=2 4008 B12R1.69 C=CCNc1ccc(Br)cc1N Amb18301937 [0,2,0,0,0,0|0,0,0]=2 4009 B12R1.69 C=CCNc1ccc(Cl)cc1Br Amb25215923 [0,2,0,0,0,0|0,0,0]=2 4010 B12R1.69 C=CCNc1ccc(Cl)cc1F Amb19058329 [0,2,0,0,0,0|0,0,0]=2 4011 B12R1.69 C=CCNc1ccc(Cl)cc1N Amb18992165 [0,2,0,0,0,0|0,0,0]=2 4012 B12R1.69 C=CCNc1ccc(F)cc1Br Amb25189603 [0,2,0,0,0,0|0,0,0]=2 4013 B12R1.69 C=CCNc1ccc(F)cc1Cl Amb19058326 [0,2,0,0,0,0|0,0,0]=2 4014 B12R1.69 C=CCNc1ccc(F)cc1N Amb18992166 [0,2,0,0,0,0|0,0,0]=2 4015 B12R1.69 C=CCNc1ccc(I)cc1Br Amb24447233 [0,2,0,0,0,0|0,0,0]=2 4016 B12R1.69 C=CCNc1ccc(I)cc1N Amb25825411 [0,2,0,0,0,0|0,0,0]=2 4017 B12R1.69 C=CCNc1ccc(N)cc1Br Amb18992182 [0,2,0,0,0,0|0,0,0]=2 4018 B12R1.69 C=CCNc1ccc(N)cc1Cl Amb18991856 [0,2,0,0,0,0|0,0,0]=2 4019 B12R1.69 C=CCNc1ccc(N)cc1F Amb18992168 [0,2,0,0,0,0|0,0,0]=2 4020 B12R1.69 C=CCNc1ccc(cc1C)C Amb17306740 [0,2,0,0,0,0|0,0,0]=2 4021 B12R1.69 C=CCNc1ccc(cc1C)Cl Amb17305814 [0,2,0,0,0,0|0,0,0]=2 4022 B12R1.69 C=CCNc1ccc(cc1Cl)Cl Amb17306788 [0,2,0,0,0,0|0,0,0]=2 4023 B12R1.69 C=CCNc1ccc(cc1F)F Amb17307293 [0,2,0,0,0,0|0,0,0]=2 4024 B12R1.69 C=CCNc1ncc(cc1Br)N Amb17213703 [0,2,0,0,0,0|1,0,0]=3 4025 B12R1.69 C=CCNc1ncc(cc1C)N Amb17210918 [0,2,0,0,0,0|1,0,0]=3 4026 B12R1.69 C=CCNc1ncc(cc1N)Br Amb17209020 [0,2,0,0,0,0|1,0,0]=3 4027 B12R1.69 C=CCNc1ncc(cc1N)C Amb17209077 [0,2,0,0,0,0|1,0,0]=3 4028 B12R1.69 C=CCNc1ncc(cc1N)Cl Amb17208955 [0,2,0,0,0,0|1,0,0]=3 4029 B12R1.69 C=CCOc1[n]cc(Br)cc1Br Amb24657852 [0,2,0,0,0,0|2,0,0]=4 4030 B12R1.69 C=CCOc1[n]cc(Br)cc1Cl Amb25816174 [0,2,0,0,0,0|2,0,0]=4 4031 B12R1.69 C=CCOc1[n]cc(Br)cc1N Amb24371540 [0,2,0,0,0,0|2,0,0]=4 4032 B12R1.69 C=CCOc1[n]cc(Cl)cc1N Amb24428844 [0,2,0,0,0,0|2,0,0]=4 4033 B12R1.69 C=CCOc1ccc(Br)cc1N Amb20207047 [0,2,0,0,0,0|1,0,0]=3 4034 B12R1.69 C=CCOc1ccc(Cl)cc1F Amb24460659 [0,2,0,0,0,0|1,0,0]=3 4035 B12R1.69 C=CCOc1ccc(N)cc1F Amb18991653 [0,2,0,0,0,0|1,0,0]=3 4036 B12R1.69 C=CCOc1ccc(N)cc1N Amb20207201 [0,2,0,0,0,0|1,0,0]=3 4037 B12R1.69 C=CCOc1ccc(cc1Br)Cl Amb17259614 [0,2,0,0,0,0|1,0,0]=3 4038 B12R1.69 C=CCOc1ccc(cc1Cl)N Amb17139077 [0,2,0,0,0,0|1,0,0]=3 4039 B12R1.69 C=CCOc1ccc(cc1N)C Amb17138556 [0,2,0,0,0,0|1,0,0]=3 4040 B12R1.69 C=CCOc1ccc(cc1N)F Amb17232632 [0,2,0,0,0,0|1,0,0]=3 4041 B12R1.69 C=CCSc1[n]cc(Br)cc1Cl Amb24412375 [0,2,0,0,0,0|2,0,0]=4 4042 B12R1.69 C=CCSc1[n]cc(Br)cc1F Amb24493470 [0,2,0,0,0,0|2,0,0]=4 4043 B12R1.69 C=CCSc1[n]cc(Br)cc1N Amb25741513 [0,2,0,0,0,0|2,0,0]=4 4044 B12R1.69 C=CCSc1[n]cc(Cl)cc1Cl Amb24343561 [0,2,0,0,0,0|2,0,0]=4 4045 B12R1.69 C=CCSc1[n]cc(Cl)cc1N Amb25207523 [0,2,0,0,0,0|2,0,0]=4 4046 B12R1.69 C=CCSc1ccc(Cl)cc1Cl Amb24493248 [0,2,0,0,0,0|1,0,0]=3 4047 B12R1.69 CC1=CC(=O)C(=CO1)OCC=C Amb25035004 [0,2,0,0,0,0|2,0,0]=4 4048 B12R1.69 CC1=CC(=O)N(CCC=C)C=C1 Amb25667492 [0,2,0,0,0,0|2,0,0]=4 4049 B12R1.69 CCCNc1ccc(N)cc1Br Amb18293593 [0,2,0,0,0,0|0,0,2]=4 4050 B12R1.69 CCCNc1ccc(N)cc1N Amb19962414 [0,2,0,0,0,0|0,0,2]=4 4051 B12R1.69 COCNc1ccc(F)cc1F Amb24637889 [0,2,0,0,0,0|1,0,1]=4 4052 B12R1.69 Cc1c[n]c(NCC=C)c(Br)c1 Amb18227512 [0,2,0,0,0,0|1,0,0]=3 4053 B12R1.69 Cc1c[n]c(OCC=C)c(Br)c1 Amb24461397 [0,2,0,0,0,0|2,0,0]=4 4054 B12R1.69 Cc1c[n]c(SCC=C)c(Br)c1 Amb25856342 [0,2,0,0,0,0|2,0,0]=4 4055 B12R1.69 Cc1c[n]c(SCC=C)c(N)c1 Amb24493414 [0,2,0,0,0,0|2,0,0]=4 4056 B12R1.69 Cc1cc(Br)c(cc1)NCCF Amb25710867 [0,2,0,0,0,0|1,0,1]=4 4057 B12R1.69 Cc1cc(Br)c[n]c1NCC=C Amb21958700 [0,2,0,0,0,0|1,0,0]=3 4058 B12R1.69 Cc1cc(Br)ccc1CCC=O Amb18070232 [0,2,0,0,0,0|2,0,0]=4 4059 B12R1.69 Cc1cc(Br)ccc1NCC=C Amb24739370 [0,2,0,0,0,0|0,0,0]=2 4060 B12R1.69 Cc1cc(C)c(CCC=O)cc1 Amb18563553 [0,2,0,0,0,0|2,0,0]=4 4061 B12R1.69 Cc1cc(C)c(cc1)NCC#C Amb18800152 [0,2,0,0,0,0|0,0,2]=4 4062 B12R1.69 Cc1cc(C)c(cc1)OCC=C Amb22266021 [0,2,0,0,0,0|1,0,0]=3 4063 B12R1.69 Cc1cc(Cl)[n]cc1OCC=C Amb24676184 [0,2,0,0,0,0|2,0,0]=4 4064 B12R1.69 Cc1cc(Cl)c(cc1)NCCF Amb24425918 [0,2,0,0,0,0|1,0,1]=4 4065 B12R1.69 Cc1cc(Cl)c(cc1)NCCN Amb18909434 [0,2,0,0,0,0|1,0,1]=4 4066 B12R1.69 Cc1cc(Cl)ccc1CCC=O Amb18564228 [0,2,0,0,0,0|2,0,0]=4 4067 B12R1.69 Cc1cc(Cl)ccc1NCC#C Amb24600626 [0,2,0,0,0,0|0,0,2]=4 4068 B12R1.69 Cc1cc(Cl)ccc1NCCF Amb25210402 [0,2,0,0,0,0|1,0,1]=4 4069 B12R1.69 Cc1cc(Cl)ccc1OCC=O Amb19075146 [0,2,0,0,0,0|2,0,0]=4 4070 B12R1.69 Cc1cc(F)c(cc1)NCCF Amb25337401 [0,2,0,0,0,0|1,0,1]=4 4071 B12R1.69 Cc1cc(F)c(cc1)NCCN Amb18908740 [0,2,0,0,0,0|1,0,1]=4 4072 B12R1.69 Cc1cc(F)ccc1CCC=O Amb25691957 [0,2,0,0,0,0|2,0,0]=4 4073 B12R1.69 Cc1cc(F)ccc1NCC#C Amb18800700 [0,2,0,0,0,0|0,0,2]=4 4074 B12R1.69 Cc1cc(F)ccc1NCC=C Amb18792655 [0,2,0,0,0,0|0,0,0]=2 4075 B12R1.69 Cc1cc(F)ccc1NCCF Amb25685410 [0,2,0,0,0,0|1,0,1]=4 4076 B12R1.69 Cc1cc(F)ccc1NCCN Amb18992220 [0,2,0,0,0,0|1,0,1]=4 4077 B12R1.69 Cc1cc(I)ccc1CCC=O Amb24696627 [0,2,0,0,0,0|2,0,0]=4 4078 B12R1.69 Cc1cc(I)ccc1NCC#N Amb25160177 [0,2,0,0,0,0|1,0,1]=4 4079 B12R1.69 Cc1cc(I)ccc1NCCN Amb25820325 [0,2,0,0,0,0|1,0,1]=4 4080 B12R1.69 Cc1cc(I)ccc1NCCO Amb25160361 [0,2,0,0,0,0|1,0,1]=4 4081 B12R1.69 Cc1cc(N)c(cc1)NCCN Amb18298682 [0,2,0,0,0,0|1,0,1]=4 4082 B12R1.69 Cc1cc(N)c[n]c1SCC=C Amb25688005 [0,2,0,0,0,0|2,0,0]=4 4083 B12R1.69 Cc1cc(N)ccc1NCC=C Amb18992169 [0,2,0,0,0,0|0,0,0]=2 4084 B12R1.69 Cc1cc(N)ccc1NCCN Amb18991506 [0,2,0,0,0,0|1,0,1]=4 4085 B12R1.69 Cc1cc(O)ccc1NCC#C Amb24410870 [0,2,0,0,0,0|0,0,2]=4 4086 B12R1.69 Cc1ccc(CCC=O)c(Br)c1 Amb18070227 [0,2,0,0,0,0|2,0,0]=4 4087 B12R1.69 Cc1ccc(CCC=O)c(Cl)c1 Amb24484219 [0,2,0,0,0,0|2,0,0]=4 4088 B12R1.69 Cc1ccc(CCC=O)c(F)c1 Amb25773961 [0,2,0,0,0,0|2,0,0]=4 4089 B12R1.69 Cc1ccc(CCC=O)c(I)c1 Amb24594357 [0,2,0,0,0,0|2,0,0]=4 4090 B12R1.69 Cc1ccc(CCC=O)c(N)c1 Amb25376377 [0,2,0,0,0,0|2,0,0]=4 4091 B12R1.69 Cc1ccc(CCC=O)c(O)c1 Amb25253209 [0,2,0,0,0,0|2,0,0]=4 4092 B12R1.69 Cc1ccc(NCC#C)c(Cl)c1 Amb18809274 [0,2,0,0,0,0|0,0,2]=4 4093 B12R1.69 Cc1ccc(NCC#C)c(F)c1 Amb18792475 [0,2,0,0,0,0|0,0,2]=4 4094 B12R1.69 Cc1ccc(NCC=C)c(Cl)c1 Amb18181534 [0,2,0,0,0,0|0,0,0]=2 4095 B12R1.69 Cc1ccc(NCC=C)c(F)c1 Amb18792656 [0,2,0,0,0,0|0,0,0]=2 4096 B12R1.69 Cc1ccc(NCC=C)c(N)c1 Amb18299130 [0,2,0,0,0,0|0,0,0]=2 4097 B12R1.69 Cc1ccc(NCCC)c(S)c1 Amb24355891 [0,2,0,0,0,0|0,0,2]=4 4098 B12R1.69 Cc1ccc(OCC=C)c(Cl)c1 Amb24416521 [0,2,0,0,0,0|1,0,0]=3 4099 B12R1.69 Cc1ccc(OCC=C)c(I)[n]1 Amb25297145 [0,2,0,0,0,0|2,0,0]=4 4100 B12R1.69 Cc1ccc(OCC=C)c(I)c1 Amb24570191 [0,2,0,0,0,0|1,0,0]=3 4101 B12R1.69 Cc1ccc(OCC=C)c(N)[n]1 Amb18991660 [0,2,0,0,0,0|2,0,0]=4 4102 B12R1.69 Cc1ccc(OCC=O)c(Cl)c1 Amb19069174 [0,2,0,0,0,0|2,0,0]=4 4103 B12R1.69 ClCCNc1ccc(cc1Br)C Amb17351915 [0,2,0,0,0,0|1,0,1]=4 4104 B12R1.69 ClCCNc1ccc(cc1C)Br Amb17351916 [0,2,0,0,0,0|1,0,1]=4 4105 B12R1.69 ClCCNc1ccc(cc1C)C Amb17335661 [0,2,0,0,0,0|1,0,1]=4 4106 B12R1.69 ClCCNc1ccc(cc1C)Cl Amb17338053 [0,2,0,0,0,0|1,0,1]=4 4107 B12R1.69 ClCCNc1ccc(cc1Cl)Cl Amb17343163 [0,2,0,0,0,0|1,0,1]=4 4108 B12R1.69 FCCNc1ccc(Cl)cc1Br Amb25284979 [0,2,0,0,0,0|1,0,1]=4 4109 B12R1.69 FCCNc1ccc(I)cc1Cl Amb25341860 [0,2,0,0,0,0|1,0,1]=4 4110 B12R1.69 Fc1cc(Br)ccc1NCCF Amb24535413 [0,2,0,0,0,0|1,0,1]=4 4111 B12R1.69 Fc1ccc(NCCF)c(Br)c1 Amb24434276 [0,2,0,0,0,0|1,0,1]=4 4112 B12R1.69 Fc1ccc(NCCF)c(Cl)c1 Amb25124418 [0,2,0,0,0,0|1,0,1]=4 4113 B12R1.69 N#CCNc1ccc(Cl)cc1Br Amb25306890 [0,2,0,0,0,0|1,0,1]=4 4114 B12R1.69 N#CCNc1ccc(Cl)cc1F Amb18954257 [0,2,0,0,0,0|1,0,1]=4 4115 B12R1.69 N#CCNc1ccc(I)cc1Cl Amb25716456 [0,2,0,0,0,0|1,0,1]=4 4116 B12R1.69 N#CCNc1ccc(cc1C)Cl Amb17400854 [0,2,0,0,0,0|1,0,1]=4 4117 B12R1.69 NCCNc1ccc(Br)cc1Cl Amb25062245 [0,2,0,0,0,0|1,0,1]=4 4118 B12R1.69 NCCNc1ccc(Cl)cc1F Amb18909785 [0,2,0,0,0,0|1,0,1]=4 4119 B12R1.69 NCCNc1ccc(F)cc1Cl Amb18909783 [0,2,0,0,0,0|1,0,1]=4 4120 B12R1.69 NCCNc1ccc(I)cc1Cl Amb25109686 [0,2,0,0,0,0|1,0,1]=4 4121 B12R1.69 NCCNc1ccc(cc1Br)C Amb17091075 [0,2,0,0,0,0|1,0,1]=4 4122 B12R1.69 NCCNc1ccc(cc1C)Br Amb17091076 [0,2,0,0,0,0|1,0,1]=4 4123 B12R1.69 NCCNc1ccc(cc1C)C Amb17057764 [0,2,0,0,0,0|1,0,1]=4 4124 B12R1.69 NCCNc1ccc(cc1C)Cl Amb17091059 [0,2,0,0,0,0|1,0,1]=4 4125 B12R1.69 NCCNc1ccc(cc1Cl)Cl Amb17091081 [0,2,0,0,0,0|1,0,1]=4 4126 B12R1.69 NCCNc1ccc(cc1F)F Amb17057761 [0,2,0,0,0,0|1,0,1]=4 4127 B12R1.69 Nc1cc(Br)c(cc1)NCCF Amb24391810 [0,2,0,0,0,0|1,0,1]=4 4128 B12R1.69 Nc1cc(Br)c(cc1)NCCO Amb18293614 [0,2,0,0,0,0|1,0,1]=4 4129 B12R1.69 Nc1cc(Br)ccc1CCC=O Amb24501344 [0,2,0,0,0,0|2,0,0]=4 4130 B12R1.69 Nc1cc(Br)ccc1NCC#N Amb20671953 [0,2,0,0,0,0|1,0,1]=4 4131 B12R1.69 Nc1cc(Br)ccc1NCCN Amb18999459 [0,2,0,0,0,0|1,0,1]=4 4132 B12R1.69 Nc1cc(Cl)c(cc1)NCCF Amb24712144 [0,2,0,0,0,0|1,0,1]=4 4133 B12R1.69 Nc1cc(Cl)ccc1NCC#N Amb20671955 [0,2,0,0,0,0|1,0,1]=4 4134 B12R1.69 Nc1cc(Cl)ccc1NCCF Amb24443635 [0,2,0,0,0,0|1,0,1]=4 4135 B12R1.69 Nc1cc(Cl)ccc1NCCN Amb18298634 [0,2,0,0,0,0|1,0,1]=4 4136 B12R1.69 Nc1cc(F)ccc1NCCF Amb25669799 [0,2,0,0,0,0|1,0,1]=4 4137 B12R1.69 Nc1cc(F)ccc1NCCN Amb18991501 [0,2,0,0,0,0|1,0,1]=4 4138 B12R1.69 Nc1cc(I)c(cc1)NCCF Amb25125089 [0,2,0,0,0,0|1,0,1]=4 4139 B12R1.69 Nc1cc(I)ccc1CCC=O Amb25311724 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.69 Nc1cc(I)ccc1NCCF Amb25036430 [0,2,0,0,0,0|1,0,1]=4 4141 B12R1.69 Nc1cc(I)ccc1NCCO Amb25150077 [0,2,0,0,0,0|1,0,1]=4 4142 B12R1.69 Nc1cc(N)c(CCC=O)cc1 Amb25268463 [0,2,0,0,0,0|2,0,0]=4 4143 B12R1.69 Nc1cc(O)ccc1CCC=O Amb24536883 [0,2,0,0,0,0|2,0,0]=4 4144 B12R1.69 Nc1cc(S)ccc1CCC=O Amb24724099 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.69 Nc1ccc(NCCN)c(Br)c1 Amb18991524 [0,2,0,0,0,0|1,0,1]=4 4146 B12R1.69 Nc1ccc(NCCN)c(Cl)c1 Amb18298651 [0,2,0,0,0,0|1,0,1]=4 4147 B12R1.69 Nc1ccc(NCCN)c(F)c1 Amb18991505 [0,2,0,0,0,0|1,0,1]=4 4148 B12R1.69 O=CCCc1ccc(Br)cc1Cl Amb24455343 [0,2,0,0,0,0|2,0,0]=4 4149 B12R1.69 O=CCCc1ccc(Br)cc1F Amb24078525 [0,2,0,0,0,0|2,0,0]=4 4150 B12R1.69 O=CCCc1ccc(Cl)cc1Br Amb24483728 [0,2,0,0,0,0|2,0,0]=4 4151 B12R1.69 O=CCCc1ccc(Cl)cc1F Amb25149928 [0,2,0,0,0,0|2,0,0]=4 4152 B12R1.69 O=CCCc1ccc(Cl)cc1S Amb25270416 [0,2,0,0,0,0|2,0,0]=4 4153 B12R1.69 O=CCCc1ccc(F)cc1Br Amb25189497 [0,2,0,0,0,0|2,0,0]=4 4154 B12R1.69 O=CCCc1ccc(F)cc1Cl Amb19070647 [0,2,0,0,0,0|2,0,0]=4 4155 B12R1.69 O=CCCc1ccc(F)cc1F Amb18801723 [0,2,0,0,0,0|2,0,0]=4 4156 B12R1.69 O=CCCc1ccc(F)cc1I Amb25305164 [0,2,0,0,0,0|2,0,0]=4 4157 B12R1.69 O=CCCc1ccc(I)cc1F Amb24728158 [0,2,0,0,0,0|2,0,0]=4 4158 B12R1.69 O=CCCc1ccc(I)cc1I Amb25242662 [0,2,0,0,0,0|2,0,0]=4 4159 B12R1.69 O=CCCc1ccc(S)cc1S Amb24696708 [0,2,0,0,0,0|2,0,0]=4 4160 B12R1.69 O=CCCc1ccc(cc1Cl)Cl Amb17612588 [0,2,0,0,0,0|2,0,0]=4 4161 B12R1.69 O=CCOc1ccc(Br)cc1Br Amb24438161 [0,2,0,0,0,0|2,0,0]=4 4162 B12R1.69 O=CCOc1ccc(Br)cc1F Amb25710965 [0,2,0,0,0,0|2,0,0]=4 4163 B12R1.69 O=CCOc1ccc(F)cc1Cl Amb18330025 [0,2,0,0,0,0|2,0,0]=4 4164 B12R1.69 O=CCOc1ccc(F)cc1F Amb18807299 [0,2,0,0,0,0|2,0,0]=4 4165 B12R1.69 O=CCOc1ccc(cc1Br)C Amb17099967 [0,2,0,0,0,0|2,0,0]=4 4166 B12R1.69 O=CCOc1ccc(cc1Br)Cl Amb17099945 [0,2,0,0,0,0|2,0,0]=4 4167 B12R1.69 O=CCOc1ccc(cc1Br)F Amb17099943 [0,2,0,0,0,0|2,0,0]=4 4168 B12R1.69 O=CCOc1ccc(cc1C)Br Amb17099968 [0,2,0,0,0,0|2,0,0]=4 4169 B12R1.69 O=CCOc1ccc(cc1Cl)Br Amb17099944 [0,2,0,0,0,0|2,0,0]=4 4170 B12R1.69 O=CCSc1ccc(F)cc1F Amb19077117 [0,2,0,0,0,0|2,0,0]=4 4171 B12R1.69 O=CCSc1ccc(cc1C)C Amb17082910 [0,2,0,0,0,0|2,0,0]=4 4172 B12R1.69 O=CCSc1ccc(cc1C)F Amb17082917 [0,2,0,0,0,0|2,0,0]=4 4173 B12R1.69 OCCNc1ccc(Br)cc1Br Amb24744028 [0,2,0,0,0,0|1,0,1]=4 4174 B12R1.69 OCCNc1ccc(Cl)cc1F Amb18987263 [0,2,0,0,0,0|1,0,1]=4 4175 B12R1.69 OCCNc1ccc(Cl)cc1I Amb25115225 [0,2,0,0,0,0|1,0,1]=4 4176 B12R1.69 OCCNc1ccc(I)cc1Br Amb25340858 [0,2,0,0,0,0|1,0,1]=4 4177 B12R1.69 OCCNc1ccc(I)cc1Cl Amb25697771 [0,2,0,0,0,0|1,0,1]=4 4178 B12R1.69 OCCNc1ccc(cc1C)Cl Amb17305825 [0,2,0,0,0,0|1,0,1]=4 4179 B12R1.69 Oc1ccc(CCC=O)c(Br)c1 Amb25040158 [0,2,0,0,0,0|2,0,0]=4 4180 B12R1.71 C#CCNc1ccc(CO)cc1 Amb25765626 [0,2,0,0,0,0|0,0,2]=4 4181 B12R1.71 C=CCCc1ccc(C=O)cc1 Amb24102789 [0,2,0,0,0,0|1,0,0]=3 4182 B12R1.71 C=CCNc1ccc(C=O)cc1 Amb18645516 [0,2,0,0,0,0|0,0,0]=2 4183 B12R1.71 C=CCNc1ccc(CN)c[n]1 Amb18563589 [0,2,0,0,0,0|1,0,0]=3 4184 B12R1.71 C=CCOc1ccc(cc1)C=O Amb1240568 [0,2,0,0,0,0|1,0,0]=3 4185 B12R1.71 C=CCOc1ccc(cc1)[Zn]Br Amb22897943 [0,2,0,0,0,0|1,0,0]=3 4186 B12R1.71 C=CCSc1c[n]c(cc1)C#N Amb25220764 [0,2,0,0,0,0|2,0,0]=4 4187 B12R1.71 C=C\C=C/c1ccc(C=O)cc1 Amb24103176 [0,2,0,0,0,0|1,0,1]=4 4188 B12R1.71 C=C\C=C/c1ccc(cc1)C#N Amb22546621 [0,2,0,0,0,0|1,0,1]=4 4189 B12R1.71 C=C\C=C\c1ccc(C=O)cc1 Amb24103152 [0,2,0,0,0,0|1,0,1]=4 4190 B12R1.71 C=C\C=C\c1ccc(CO)cc1 Amb25156735 [0,2,0,0,0,0|1,0,1]=4 4191 B12R1.71 CCCNc1ccc(C=O)cc1 Amb25055167 [0,2,0,0,0,0|0,0,2]=4 4192 B12R1.71 CCCNc1ccc(CN)cc1 Amb18800849 [0,2,0,0,0,0|0,0,2]=4 4193 B12R1.71 CCCNc1ccc(CO)cc1 Amb25734032 [0,2,0,0,0,0|0,0,2]=4 4194 B12R1.71 CCCNc1ccc(cc1)N=O Amb25096367 [0,2,0,0,0,0|0,0,2]=4 4195 B12R1.71 CCc1ccc(cc1)CCC=O Amb17081676 [0,2,0,0,0,0|2,0,0]=4 4196 B12R1.71 CCc1ccc(cc1)NCC#C Amb18800155 [0,2,0,0,0,0|0,0,2]=4 4197 B12R1.71 CCc1ccc(cc1)NCC=C Amb17306600 [0,2,0,0,0,0|0,0,0]=2 4198 B12R1.71 CCc1ccc(cc1)NCCF Amb24539836 [0,2,0,0,0,0|1,0,1]=4 4199 B12R1.71 CCc1ccc(cc1)SCC=O Amb17082912 [0,2,0,0,0,0|2,0,0]=4 4200 B12R1.71 CNc1ccc(cc1)OCC=C Amb19009330 [0,2,0,0,0,0|1,0,0]=3 4201 B12R1.71 COCNc1ccc(cc1)C#N Amb24666505 [0,2,0,0,0,0|1,0,1]=4 4202 B12R1.71 COc1ccc(CNC=C)cc1 Amb25063053 [0,2,0,0,0,0|2,0,0]=4 4203 B12R1.71 COc1ccc(\C=C\C=C)cc1 Amb22546592 [0,2,0,0,0,0|1,0,1]=4 4204 B12R1.71 COc1ccc(c[n]1)NCC=C Amb18792566 [0,2,0,0,0,0|1,0,0]=3 4205 B12R1.71 COc1ccc(cc1)NCC=C Amb21955330 [0,2,0,0,0,0|0,0,0]=2 4206 B12R1.71 COc1ccc(cc1)NCCF Amb24410912 [0,2,0,0,0,0|1,0,1]=4 4207 B12R1.71 COc1ccc(cc1)NCOC Amb25312070 [0,2,0,0,0,0|1,0,1]=4 4208 B12R1.71 COc1ccc(cc1)SCC=O Amb17082908 [0,2,0,0,0,0|2,0,0]=4 4209 B12R1.71 CSc1c[n]c(NCC=C)[n]c1 Amb24525402 [0,2,0,0,0,0|2,0,0]=4 4210 B12R1.71 CSc1ccc(CCC=O)cc1 Amb24093033 [0,2,0,0,0,0|2,0,0]=4 4211 B12R1.71 CSc1ccc(NCC=C)[n][n]1 Amb24343666 [0,2,0,0,0,0|2,0,0]=4 4212 B12R1.71 CSc1ccc(cc1)NCC#C Amb18809002 [0,2,0,0,0,0|0,0,2]=4 4213 B12R1.71 CSc1ccc(cc1)NCC=C Amb18796190 [0,2,0,0,0,0|0,0,0]=2 4214 B12R1.71 CSc1ccc(cc1)NCCN Amb18243831 [0,2,0,0,0,0|1,0,1]=4 4215 B12R1.71 C\C=N\Nc1ccc(cc1)OC Amb25190096 [0,2,0,0,0,0|1,0,1]=4 4216 B12R1.71 ClCCNc1ccc(cc1)C#N Amb17335462 [0,2,0,0,0,0|1,0,1]=4 4217 B12R1.71 ClCCNc1ccc(cc1)CC Amb17335668 [0,2,0,0,0,0|1,0,1]=4 4218 B12R1.71 ClCCNc1ccc(cc1)OC Amb17335808 [0,2,0,0,0,0|1,0,1]=4 4219 B12R1.71 N#Cc1ccc(CCC=O)cc1 Amb24093122 [0,2,0,0,0,0|2,0,0]=4 4220 B12R1.71 N#Cc1ccc(cc1)OCC=O Amb18800495 [0,2,0,0,0,0|2,0,0]=4 4221 B12R1.71 NCCNc1ccc(CO)cc1 Amb25719187 [0,2,0,0,0,0|1,0,1]=4 4222 B12R1.71 NCCNc1ccc(cc1)CC Amb17057758 [0,2,0,0,0,0|1,0,1]=4 4223 B12R1.71 NCCNc1ccc(cc1)OC Amb10604015 [0,2,0,0,0,0|1,0,1]=4 4224 B12R1.71 O=Cc1ccc(CCC=O)cc1 Amb18645655 [0,2,0,0,0,0|2,0,0]=4 4225 B12R1.71 O=Cc1ccc(cc1)NCCF Amb25178323 [0,2,0,0,0,0|1,0,1]=4 4226 B12R1.71 OCc1ccc(cc1)NCCCl Amb25257978 [0,2,0,0,0,0|1,0,1]=4 4227 B12R1.71 OCc1ccc(cc1)OCC=C Amb1111157 [0,2,0,0,0,0|1,0,0]=3 4228 B12R1.385 C#CCNc1cc(Cl)c(Cl)cc1 Amb18332697 [0,2,0,0,0,0|0,0,2]=4 4229 B12R1.385 C#CCNc1ccc(Br)c(Cl)c1 Amb25052808 [0,2,0,0,0,0|0,0,2]=4 4230 B12R1.385 C#CCNc1ccc(Br)c(F)c1 Amb24370436 [0,2,0,0,0,0|0,0,2]=4 4231 B12R1.385 C#CCNc1ccc(Br)c(I)c1 Amb24493453 [0,2,0,0,0,0|0,0,2]=4 4232 B12R1.385 C#CCNc1ccc(Cl)c(Br)c1 Amb25805877 [0,2,0,0,0,0|0,0,2]=4 4233 B12R1.385 C#CCNc1ccc(Cl)c(F)c1 Amb19057369 [0,2,0,0,0,0|0,0,2]=4 4234 B12R1.385 C#CCNc1ccc(I)c(Br)c1 Amb24493643 [0,2,0,0,0,0|0,0,2]=4 4235 B12R1.385 C#CCNc1ccc(c(c1)F)F Amb17307337 [0,2,0,0,0,0|0,0,2]=4 4236 B12R1.385 C=CCCc1ccc(F)c(Br)c1 Amb25375534 [0,2,0,0,0,0|1,0,0]=3 4237 B12R1.385 C=CCNc1ccc(Br)c(Cl)c1 Amb24476383 [0,2,0,0,0,0|0,0,0]=2 4238 B12R1.385 C=CCNc1ccc(Br)c(I)c1 Amb24730252 [0,2,0,0,0,0|0,0,0]=2 4239 B12R1.385 C=CCNc1ccc(Cl)c(F)c1 Amb19058328 [0,2,0,0,0,0|0,0,0]=2 4240 B12R1.385 C=CCNc1ccc(I)c(Br)c1 Amb25791454 [0,2,0,0,0,0|0,0,0]=2 4241 B12R1.385 C=CCNc1ccc(c(c1)Br)C Amb17307018 [0,2,0,0,0,0|0,0,0]=2 4242 B12R1.385 C=CCNc1ccc(c(c1)C)C Amb17306087 [0,2,0,0,0,0|0,0,0]=2 4243 B12R1.385 C=CCNc1ccc(c(c1)Cl)C Amb17306819 [0,2,0,0,0,0|0,0,0]=2 4244 B12R1.385 C=CCNc1ccc(c(c1)Cl)Cl Amb17305990 [0,2,0,0,0,0|0,0,0]=2 4245 B12R1.385 C=CCNc1ccc(c(c1)Cl)F Amb17305851 [0,2,0,0,0,0|0,0,0]=2 4246 B12R1.385 C=CCNc1ccc(c(c1)F)F Amb17307313 [0,2,0,0,0,0|0,0,0]=2 4247 B12R1.385 C=CCOc1cc(Cl)c(Cl)cc1 Amb24361907 [0,2,0,0,0,0|1,0,0]=3 4248 B12R1.385 C=CCOc1cc(F)c(F)cc1 Amb24082974 [0,2,0,0,0,0|1,0,0]=3 4249 B12R1.385 C=CCOc1cc(N)c(N)cc1 Amb24377079 [0,2,0,0,0,0|1,0,0]=3 4250 B12R1.385 C=CCOc1ccc(Br)c(N)c1 Amb23555853 [0,2,0,0,0,0|1,0,0]=3 4251 B12R1.385 C=CCOc1ccc(Cl)c(F)c1 Amb25783253 [0,2,0,0,0,0|1,0,0]=3 4252 B12R1.385 C=CCOc1ccc(F)c(Br)c1 Amb25328171 [0,2,0,0,0,0|1,0,0]=3 4253 B12R1.385 C=CCOc1ccc(F)c(Cl)c1 Amb24543710 [0,2,0,0,0,0|1,0,0]=3 4254 B12R1.385 C=CCOc1ccc(N)c(Cl)c1 Amb18991661 [0,2,0,0,0,0|1,0,0]=3 4255 B12R1.385 C=CCOc1ccc(N)c(F)c1 Amb18991658 [0,2,0,0,0,0|1,0,0]=3 4256 B12R1.385 C=CCOc1ccc(O)c(N)c1 Amb25055173 [0,2,0,0,0,0|1,0,0]=3 4257 B12R1.385 C=CCOc1ccc(c(c1)C)N Amb17138560 [0,2,0,0,0,0|1,0,0]=3 4258 B12R1.385 C=CCOc1ccc(c(c1)N)C Amb17138559 [0,2,0,0,0,0|1,0,0]=3 4259 B12R1.385 C=CCOc1ccc(c(c1)N)Cl Amb17139076 [0,2,0,0,0,0|1,0,0]=3 4260 B12R1.385 C=CCSc1cc(Cl)c(Cl)cc1 Amb25160463 [0,2,0,0,0,0|1,0,0]=3 4261 B12R1.385 C=CCSc1ccc(Cl)c(F)c1 Amb24427682 [0,2,0,0,0,0|1,0,0]=3 4262 B12R1.385 CC1=CN=C(NCC=C)NC1=O Amb24649423 [0,2,0,0,0,0|2,0,0]=4 4263 B12R1.385 CCCNc1cc(Br)c(Cl)cc1 Amb24487633 [0,2,0,0,0,0|0,0,2]=4 4264 B12R1.385 CCCNc1cc(Br)c(I)cc1 Amb24493642 [0,2,0,0,0,0|0,0,2]=4 4265 B12R1.385 CCCNc1ccc(c(c1)Br)C Amb17142401 [0,2,0,0,0,0|0,0,2]=4 4266 B12R1.385 CN1C=CC(NCC=C)=NC1=O Amb25800116 [0,2,0,0,0,0|2,0,0]=4 4267 B12R1.385 Cc1[n]c(NCC=C)[n]cc1Br Amb24612014 [0,2,0,0,0,0|2,0,0]=4 4268 B12R1.385 Cc1[n]c(ccc1Br)OCC=C Amb25113710 [0,2,0,0,0,0|2,0,0]=4 4269 B12R1.385 Cc1[n]c(ccc1Br)SCC=C Amb25346487 [0,2,0,0,0,0|2,0,0]=4 4270 B12R1.385 Cc1[n]c(ccc1N)OCC=C Amb24702111 [0,2,0,0,0,0|2,0,0]=4 4271 B12R1.385 Cc1[n]c(ccc1N)SCC=C Amb25832185 [0,2,0,0,0,0|2,0,0]=4 4272 B12R1.385 Cc1c[n]c(cc1N)NCC=C Amb25265124 [0,2,0,0,0,0|1,0,0]=3 4273 B12R1.385 Cc1cc(CCC=C)ccc1F Amb25064356 [0,2,0,0,0,0|1,0,0]=3 4274 B12R1.385 Cc1cc(CCC=O)ccc1Br Amb18070236 [0,2,0,0,0,0|2,0,0]=4 4275 B12R1.385 Cc1cc(CCC=O)ccc1C Amb18798124 [0,2,0,0,0,0|2,0,0]=4 4276 B12R1.385 Cc1cc(CCC=O)ccc1F Amb25682112 [0,2,0,0,0,0|2,0,0]=4 4277 B12R1.385 Cc1cc(CCC=O)ccc1I Amb24603486 [0,2,0,0,0,0|2,0,0]=4 4278 B12R1.385 Cc1cc(CCC=O)ccc1O Amb25838807 [0,2,0,0,0,0|2,0,0]=4 4279 B12R1.385 Cc1cc(NCC=C)[n]cc1Br Amb21958697 [0,2,0,0,0,0|1,0,0]=3 4280 B12R1.385 Cc1cc(NCC=C)ncc1N Amb17213760 [0,2,0,0,0,0|1,0,0]=3 4281 B12R1.385 Cc1cc([n]cc1N)SCC=C Amb24354725 [0,2,0,0,0,0|2,0,0]=4 4282 B12R1.385 Cc1cc(ccc1Br)NCC=C Amb25828186 [0,2,0,0,0,0|0,0,0]=2 4283 B12R1.385 Cc1cc(ccc1C)NCC#C Amb18800153 [0,2,0,0,0,0|0,0,2]=4 4284 B12R1.385 Cc1cc(ccc1Cl)OCC=C Amb25283208 [0,2,0,0,0,0|1,0,0]=3 4285 B12R1.385 Cc1cc(ccc1Cl)SCC=C Amb25074497 [0,2,0,0,0,0|1,0,0]=3 4286 B12R1.385 Cc1cc(ccc1F)NCC#C Amb18792478 [0,2,0,0,0,0|0,0,2]=4 4287 B12R1.385 Cc1cc(ccc1F)NCC#N Amb18287558 [0,2,0,0,0,0|1,0,1]=4 4288 B12R1.385 Cc1cc(ccc1F)NCC=C Amb18792659 [0,2,0,0,0,0|0,0,0]=2 4289 B12R1.385 Cc1cc(ccc1F)NCCC Amb18792942 [0,2,0,0,0,0|0,0,2]=4 4290 B12R1.385 Cc1cc(ccc1F)NCCF Amb25738928 [0,2,0,0,0,0|1,0,1]=4 4291 B12R1.385 Cc1cc(ccc1F)NCCN Amb18299162 [0,2,0,0,0,0|1,0,1]=4 4292 B12R1.385 Cc1cc(ccc1F)NCCO Amb18301456 [0,2,0,0,0,0|1,0,1]=4 4293 B12R1.385 Cc1cc(ccc1F)OCC=C Amb24591308 [0,2,0,0,0,0|1,0,0]=3 4294 B12R1.385 Cc1cc(ccc1N)NCC=C Amb18299131 [0,2,0,0,0,0|0,0,0]=2 4295 B12R1.385 Cc1cc(ccc1N)NCCF Amb24375199 [0,2,0,0,0,0|1,0,1]=4 4296 B12R1.385 Cc1cc(ccc1N)NCCN Amb18298683 [0,2,0,0,0,0|1,0,1]=4 4297 B12R1.385 Cc1cc(ccc1N)SCC=C Amb25350067 [0,2,0,0,0,0|1,0,0]=3 4298 B12R1.385 Cc1cc(ccc1O)NCC#C Amb25239985 [0,2,0,0,0,0|0,0,2]=4 4299 B12R1.385 Cc1ccc(CCC=C)cc1Cl Amb24426879 [0,2,0,0,0,0|1,0,0]=3 4300 B12R1.385 Cc1ccc(CCC=C)cc1F Amb25113932 [0,2,0,0,0,0|1,0,0]=3 4301 B12R1.385 Cc1ccc(CCC=O)cc1Br Amb18069967 [0,2,0,0,0,0|2,0,0]=4 4302 B12R1.385 Cc1ccc(CCC=O)cc1Cl Amb18564229 [0,2,0,0,0,0|2,0,0]=4 4303 B12R1.385 Cc1ccc(CCC=O)cc1F Amb24093026 [0,2,0,0,0,0|2,0,0]=4 4304 B12R1.385 Cc1ccc(CCC=O)cc1I Amb25118646 [0,2,0,0,0,0|2,0,0]=4 4305 B12R1.385 Cc1ccc(cc1Br)NCCF Amb25859409 [0,2,0,0,0,0|1,0,1]=4 4306 B12R1.385 Cc1ccc(cc1Br)OCC=C Amb22896490 [0,2,0,0,0,0|1,0,0]=3 4307 B12R1.385 Cc1ccc(cc1Cl)NCC#C Amb18186521 [0,2,0,0,0,0|0,0,2]=4 4308 B12R1.385 Cc1ccc(cc1Cl)SCC=C Amb25321211 [0,2,0,0,0,0|1,0,0]=3 4309 B12R1.385 Cc1ccc(cc1F)NCC#C Amb18800699 [0,2,0,0,0,0|0,0,2]=4 4310 B12R1.385 Cc1ccc(cc1F)NCC=C Amb18792654 [0,2,0,0,0,0|0,0,0]=2 4311 B12R1.385 Cc1ccc(cc1F)NCCF Amb25082185 [0,2,0,0,0,0|1,0,1]=4 4312 B12R1.385 Cc1ccc(cc1F)NCCN Amb18251976 [0,2,0,0,0,0|1,0,1]=4 4313 B12R1.385 Cc1ccc(cc1F)OCC=C Amb25816239 [0,2,0,0,0,0|1,0,0]=3 4314 B12R1.385 Cc1ccc(cc1F)SCC=C Amb25114672 [0,2,0,0,0,0|1,0,0]=3 4315 B12R1.385 Cc1ccc(cc1I)NCCF Amb24531465 [0,2,0,0,0,0|1,0,1]=4 4316 B12R1.385 Cc1ccc(cc1I)NCCN Amb25757086 [0,2,0,0,0,0|1,0,1]=4 4317 B12R1.385 Cc1ccc(cc1N)NCC=C Amb18302092 [0,2,0,0,0,0|0,0,0]=2 4318 B12R1.385 Cc1ccc(cc1N)NCCC Amb18302069 [0,2,0,0,0,0|0,0,2]=4 4319 B12R1.385 Cc1ccc(cc1N)NCCF Amb25669796 [0,2,0,0,0,0|1,0,1]=4 4320 B12R1.385 Cc1ccc(cc1N)NCCN Amb18999842 [0,2,0,0,0,0|1,0,1]=4 4321 B12R1.385 Cc1ccc(cc1N)NCCO Amb18999456 [0,2,0,0,0,0|1,0,1]=4 4322 B12R1.385 Cc1ccc(cc1N)SCC=C Amb24493609 [0,2,0,0,0,0|1,0,0]=3 4323 B12R1.385 Cc1ccc(cc1O)NCCN Amb25755404 [0,2,0,0,0,0|1,0,1]=4 4324 B12R1.385 Cc1nc(NCC=C)ccc1N Amb17213829 [0,2,0,0,0,0|1,0,0]=3 4325 B12R1.385 ClCCNc1ccc(c(c1)Br)C Amb17351914 [0,2,0,0,0,0|1,0,1]=4 4326 B12R1.385 ClCCNc1ccc(c(c1)C)Br Amb17351917 [0,2,0,0,0,0|1,0,1]=4 4327 B12R1.385 ClCCNc1ccc(c(c1)C)C Amb17335663 [0,2,0,0,0,0|1,0,1]=4 4328 B12R1.385 ClCCNc1ccc(c(c1)Cl)C Amb17338054 [0,2,0,0,0,0|1,0,1]=4 4329 B12R1.385 ClCCNc1ccc(c(c1)Cl)Cl Amb17343162 [0,2,0,0,0,0|1,0,1]=4 4330 B12R1.385 ClCCNc1ccc(c(c1)Cl)F Amb17338959 [0,2,0,0,0,0|1,0,1]=4 4331 B12R1.385 FCCNc1cc(Br)c(Cl)cc1 Amb25297749 [0,2,0,0,0,0|1,0,1]=4 4332 B12R1.385 FCCNc1cc(F)c(F)cc1 Amb25726274 [0,2,0,0,0,0|1,0,1]=4 4333 B12R1.385 Fc1cc(ccc1Br)NCCF Amb25086182 [0,2,0,0,0,0|1,0,1]=4 4334 B12R1.385 Fc1ccc(cc1Cl)NCCF Amb25156652 [0,2,0,0,0,0|1,0,1]=4 4335 B12R1.385 N#CCNc1ccc(Br)c(Cl)c1 Amb24459097 [0,2,0,0,0,0|1,0,1]=4 4336 B12R1.385 N#CCNc1ccc(Br)c(I)c1 Amb24493454 [0,2,0,0,0,0|1,0,1]=4 4337 B12R1.385 N#CCNc1ccc(Cl)c(F)c1 Amb18954761 [0,2,0,0,0,0|1,0,1]=4 4338 B12R1.385 N#CCNc1ccc(c(c1)Br)C Amb17406667 [0,2,0,0,0,0|1,0,1]=4 4339 B12R1.385 N#CCNc1ccc(c(c1)Cl)F Amb17401045 [0,2,0,0,0,0|1,0,1]=4 4340 B12R1.385 NCCNc1cc(Br)c(Cl)cc1 Amb24414229 [0,2,0,0,0,0|1,0,1]=4 4341 B12R1.385 NCCNc1cc(Br)c(F)cc1 Amb25327051 [0,2,0,0,0,0|1,0,1]=4 4342 B12R1.385 NCCNc1cc(Cl)c(Br)cc1 Amb24416528 [0,2,0,0,0,0|1,0,1]=4 4343 B12R1.385 NCCNc1cc(Cl)c(O)cc1 Amb25094658 [0,2,0,0,0,0|1,0,1]=4 4344 B12R1.385 NCCNc1cc(F)c(Cl)cc1 Amb18909784 [0,2,0,0,0,0|1,0,1]=4 4345 B12R1.385 NCCNc1cc(F)c(O)cc1 Amb25793339 [0,2,0,0,0,0|1,0,1]=4 4346 B12R1.385 NCCNc1cc(I)c(Br)cc1 Amb24408786 [0,2,0,0,0,0|1,0,1]=4 4347 B12R1.385 NCCNc1cc(N)c(N)cc1 Amb24543629 [0,2,0,0,0,0|1,0,1]=4 4348 B12R1.385 NCCNc1ccc(c(c1)Br)C Amb17091063 [0,2,0,0,0,0|1,0,1]=4 4349 B12R1.385 NCCNc1ccc(c(c1)C)Br Amb17091077 [0,2,0,0,0,0|1,0,1]=4 4350 B12R1.385 NCCNc1ccc(c(c1)C)C Amb17091052 [0,2,0,0,0,0|1,0,1]=4 4351 B12R1.385 NCCNc1ccc(c(c1)Cl)C Amb17091060 [0,2,0,0,0,0|1,0,1]=4 4352 B12R1.385 NCCNc1ccc(c(c1)Cl)Cl Amb17091080 [0,2,0,0,0,0|1,0,1]=4 4353 B12R1.385 NCCNc1ccc(c(c1)Cl)F Amb17057760 [0,2,0,0,0,0|1,0,1]=4 4354 B12R1.385 NCCNc1ccc(c(c1)F)F Amb17057762 [0,2,0,0,0,0|1,0,1]=4 4355 B12R1.385 Nc1cc(CCC=O)ccc1Cl Amb24759207 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.385 Nc1cc(ccc1N)NCC#N Amb24710362 [0,2,0,0,0,0|1,0,1]=4 4357 B12R1.385 Nc1cc(ccc1N)NCCO Amb24468320 [0,2,0,0,0,0|1,0,1]=4 4358 B12R1.385 Nc1ccc(CCC=O)cc1O Amb24536884 [0,2,0,0,0,0|2,0,0]=4 4359 B12R1.385 O=CCCc1cc(Br)c(Br)cc1 Amb25301219 [0,2,0,0,0,0|2,0,0]=4 4360 B12R1.385 O=CCCc1cc(Cl)c(Cl)cc1 Amb24093018 [0,2,0,0,0,0|2,0,0]=4 4361 B12R1.385 O=CCCc1cc(F)c(F)cc1 Amb18563918 [0,2,0,0,0,0|2,0,0]=4 4362 B12R1.385 O=CCCc1ccc(Br)c(F)c1 Amb25733243 [0,2,0,0,0,0|2,0,0]=4 4363 B12R1.385 O=CCCc1ccc(Br)c(I)c1 Amb25301482 [0,2,0,0,0,0|2,0,0]=4 4364 B12R1.385 O=CCCc1ccc(Cl)c(Br)c1 Amb24382161 [0,2,0,0,0,0|2,0,0]=4 4365 B12R1.385 O=CCCc1ccc(Cl)c(F)c1 Amb25836345 [0,2,0,0,0,0|2,0,0]=4 4366 B12R1.385 O=CCCc1ccc(Cl)c(I)c1 Amb25690980 [0,2,0,0,0,0|2,0,0]=4 4367 B12R1.385 O=CCCc1ccc(F)c(Br)c1 Amb24093021 [0,2,0,0,0,0|2,0,0]=4 4368 B12R1.385 O=CCCc1ccc(F)c(Cl)c1 Amb18564403 [0,2,0,0,0,0|2,0,0]=4 4369 B12R1.385 O=CCCc1ccc(I)c(Cl)c1 Amb25268272 [0,2,0,0,0,0|2,0,0]=4 4370 B12R1.385 O=CCCc1ccc(I)c(S)c1 Amb24541086 [0,2,0,0,0,0|2,0,0]=4 4371 B12R1.385 O=CCCc1ccc(S)c(F)c1 Amb24603942 [0,2,0,0,0,0|2,0,0]=4 4372 B12R1.385 O=CCOc1cc(F)c(F)cc1 Amb18807300 [0,2,0,0,0,0|2,0,0]=4 4373 B12R1.385 O=CCOc1ccc(Br)c(Cl)c1 Amb25138911 [0,2,0,0,0,0|2,0,0]=4 4374 B12R1.385 O=CCOc1ccc(Br)c(F)c1 Amb24429474 [0,2,0,0,0,0|2,0,0]=4 4375 B12R1.385 O=CCOc1ccc(F)c(Br)c1 Amb25314122 [0,2,0,0,0,0|2,0,0]=4 4376 B12R1.385 O=CCOc1ccc(F)c(Cl)c1 Amb18330026 [0,2,0,0,0,0|2,0,0]=4 4377 B12R1.385 O=CCOc1ccc(c(c1)C)Br Amb17099969 [0,2,0,0,0,0|2,0,0]=4 4378 B12R1.385 O=CCSc1cc(F)c(F)cc1 Amb19077116 [0,2,0,0,0,0|2,0,0]=4 4379 B12R1.385 O=CCSc1ccc(c(c1)C)C Amb17082909 [0,2,0,0,0,0|2,0,0]=4 4380 B12R1.385 O=CCSc1ccc(c(c1)C)Cl Amb17082933 [0,2,0,0,0,0|2,0,0]=4 4381 B12R1.385 O=CCSc1ccc(c(c1)C)F Amb17082916 [0,2,0,0,0,0|2,0,0]=4 4382 B12R1.385 O=CCSc1ccc(c(c1)Cl)Cl Amb17082918 [0,2,0,0,0,0|2,0,0]=4 4383 B12R1.385 O=CNNc1ccc(Cl)c(Cl)c1 Amb22486916 [0,2,0,0,0,0|2,0,0]=4 4384 B12R1.385 OCCNc1cc(Br)c(I)cc1 Amb25310897 [0,2,0,0,0,0|1,0,1]=4 4385 B12R1.385 OCCNc1cc(F)c(Cl)cc1 Amb18294793 [0,2,0,0,0,0|1,0,1]=4 4386 B12R1.385 OCCNc1ccc(c(c1)Br)C Amb17307023 [0,2,0,0,0,0|1,0,1]=4 4387 B12R1.385 OCCNc1ccc(c(c1)Cl)F Amb17305858 [0,2,0,0,0,0|1,0,1]=4 4388 B12R1.385 Oc1cc(CCC=O)ccc1Br Amb24341987 [0,2,0,0,0,0|2,0,0]=4 4389 B12R1.385 Oc1cc(CCC=O)ccc1Cl Amb25806089 [0,2,0,0,0,0|2,0,0]=4 4390 B12R1.385 Oc1cc(CCC=O)ccc1F Amb25360910 [0,2,0,0,0,0|2,0,0]=4 4391 B12R1.385 Oc1ccc(CCC=O)cc1Cl Amb25150852 [0,2,0,0,0,0|2,0,0]=4 4392 B12R1.385 Oc1ccc(CCC=O)cc1I Amb24758933 [0,2,0,0,0,0|2,0,0]=4 4393 B12R1.2259 C=CCCC1(O)C=CC(=O)C=C1 Amb25767787 [0,2,0,0,0,0|1,0,1]=4 4394 B12R1.3 C#CCN(C#N)c1ccccc1 Amb25215647 [0,2,0,0,0,0|0,0,2]=4 4395 B12R1.3 C=C=C(CC=O)c1ccccc1 Amb25277163 [0,2,0,0,0,0|2,0,0]=4 4396 B12R1.3 C=CCC(C#N)c1cccc[n]1 Amb18645087 [0,2,0,0,0,0|2,0,0]=4 4397 B12R1.3 C=CCC(c1ccccc1)C#N Amb17593937 [0,2,0,0,0,0|1,0,0]=3 4398 B12R1.3 C=CC\C(=N\N)\c1ccccc1 Amb24473453 [0,2,0,0,0,0|1,0,0]=3 4399 B12R1.3 C=C\C=C(\C=O)/c1ccccc1 Amb25768466 [0,2,0,0,0,0|1,0,1]=4 4400 B12R1.3 COCN(C#N)c1ccccc1 Amb24705539 [0,2,0,0,0,0|1,0,1]=4 4401 B12R1.3 CSCN(C#N)c1ccccc1 Amb25278868 [0,2,0,0,0,0|1,0,1]=4 4402 B12R1.3 N#CN(CCF)c1ccccc1 Amb25795104 [0,2,0,0,0,0|1,0,1]=4 4403 B12R1.3 N#CN(CCO)c1ccccc1 Amb24349826 [0,2,0,0,0,0|1,0,1]=4 4404 B12R1.3 NCCN(c1ccccc1)CC Amb1136918 [0,2,0,0,0,0|1,0,1]=4 4405 B12R1.3 OCCN(c1ccccc1)CC Amb1208392 [0,2,0,0,0,0|1,0,1]=4 4406 B12R1.3 SCCN(c1ccccc1)CC Amb13881733 [0,2,0,0,0,0|1,0,1]=4 4407 B12R1.17 C=CCC(=O)c1c[n]cc(Br)c1 Amb24457165 [0,2,0,0,0,0|2,0,0]=4 4408 B12R1.17 C=CCC(=O)c1cccc(F)c1 Amb18788273 [0,2,0,0,0,0|1,0,0]=3 4409 B12R1.17 C=CCC(=O)c1cccc(N)c1 Amb24453604 [0,2,0,0,0,0|1,0,0]=3 4410 B12R1.17 C=CCC(=O)c1cccc(c1)Br Amb17343201 [0,2,0,0,0,0|1,0,0]=3 4411 B12R1.17 C=CCC(=O)c1cccc(c1)C Amb17334498 [0,2,0,0,0,0|1,0,0]=3 4412 B12R1.17 C=CCC(=O)c1cccc(c1)Cl Amb17335457 [0,2,0,0,0,0|1,0,0]=3 4413 B12R1.17 C=CCC(=O)c1cccc(c1)O Amb17334559 [0,2,0,0,0,0|1,0,0]=3 4414 B12R1.17 C=CCC(N)c1c[n]cc(Br)c1 Amb25313265 [0,2,0,0,0,0|2,0,0]=4 4415 B12R1.17 C=CCC(N)c1c[n]cc(O)c1 Amb24411547 [0,2,0,0,0,0|2,0,0]=4 4416 B12R1.17 C=CCC(N)c1cc(Cl)cc[n]1 Amb25084587 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.17 C=CCC(N)c1cc(N)[n]cc1 Amb24560917 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.17 C=CCC(N)c1cc(N)c[n]c1 Amb24598846 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.17 C=CCC(N)c1cc(N)ccc1 Amb24417276 [0,2,0,0,0,0|1,0,0]=3 4420 B12R1.17 C=CCC(N)c1cc[n]c(Br)c1 Amb25758982 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.17 C=CCC(N)c1cc[n]c(Cl)c1 Amb25314087 [0,2,0,0,0,0|2,0,0]=4 4422 B12R1.17 C=CCC(N)c1cc[n]c(F)c1 Amb25121078 [0,2,0,0,0,0|2,0,0]=4 4423 B12R1.17 C=CCC(N)c1cccc(Br)c1 Amb18292095 [0,2,0,0,0,0|1,0,0]=3 4424 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,2,0,0,0,0|1,0,0]=3 4425 B12R1.17 C=CCC(N)c1cccc(F)c1 Amb18977587 [0,2,0,0,0,0|1,0,0]=3 4426 B12R1.17 C=CCC(O)c1c[n]cc(Br)c1 Amb25762315 [0,2,0,0,0,0|2,0,0]=4 4427 B12R1.17 C=CCC(O)c1c[n]cc(F)c1 Amb25255794 [0,2,0,0,0,0|2,0,0]=4 4428 B12R1.17 C=CCC(O)c1cc(O)ccc1 Amb18646052 [0,2,0,0,0,0|1,0,0]=3 4429 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,2,0,0,0,0|1,0,0]=3 4430 B12R1.17 C=CCC(O)c1cccc(N)c1 Amb25674950 [0,2,0,0,0,0|1,0,0]=3 4431 B12R1.17 C=CC[C@@H](N)c1c[n]cc(Cl)c1 Amb25684274 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.17 C=CC[C@@H](N)c1c[n]cc(F)c1 Amb25791192 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.17 C=CC[C@@H](N)c1c[n]cc(O)c1 Amb25261509 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.17 C=CC[C@@H](N)c1cc(Br)cc[n]1 Amb24483671 [0,2,0,0,0,0|2,0,0]=4 4435 B12R1.17 C=CC[C@@H](N)c1cc(Cl)cc[n]1 Amb25680128 [0,2,0,0,0,0|2,0,0]=4 4436 B12R1.17 C=CC[C@@H](N)c1cc[n]c(F)c1 Amb24487134 [0,2,0,0,0,0|2,0,0]=4 4437 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb19929879 [0,2,0,0,0,0|1,0,0]=3 4438 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb22831442 [0,2,0,0,0,0|1,0,0]=3 4439 B12R1.17 C=CC[C@@H](N)c1cccc(Cl)[n]1 Amb24341766 [0,2,0,0,0,0|2,0,0]=4 4440 B12R1.17 C=CC[C@@H](N)c1cccc(Cl)c1 Amb22831578 [0,2,0,0,0,0|1,0,0]=3 4441 B12R1.17 C=CC[C@@H](N)c1cccc(F)[n]1 Amb24744496 [0,2,0,0,0,0|2,0,0]=4 4442 B12R1.17 C=CC[C@@H](N)c1cccc(N)[n]1 Amb24351672 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.17 C=CC[C@@H](N)c1cccc(O)[n]1 Amb24376683 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.17 C=CC[C@@H](O)c1cc(O)ccc1 Amb25352493 [0,2,0,0,0,0|1,0,0]=3 4445 B12R1.17 C=CC[C@@H](O)c1cccc(Br)c1 Amb24637865 [0,2,0,0,0,0|1,0,0]=3 4446 B12R1.17 C=CC[C@@H](O)c1cccc(S)c1 Amb25706098 [0,2,0,0,0,0|1,0,0]=3 4447 B12R1.17 C=CC[C@H](N)c1c[n]cc(F)c1 Amb25340512 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.17 C=CC[C@H](N)c1cc(Br)cc[n]1 Amb25096461 [0,2,0,0,0,0|2,0,0]=4 4449 B12R1.17 C=CC[C@H](N)c1cc(Cl)cc[n]1 Amb24487163 [0,2,0,0,0,0|2,0,0]=4 4450 B12R1.17 C=CC[C@H](N)c1cc(N)[n]cc1 Amb24745618 [0,2,0,0,0,0|2,0,0]=4 4451 B12R1.17 C=CC[C@H](N)c1cc(N)c[n]c1 Amb24655935 [0,2,0,0,0,0|2,0,0]=4 4452 B12R1.17 C=CC[C@H](N)c1cc(N)cc[n]1 Amb24351214 [0,2,0,0,0,0|2,0,0]=4 4453 B12R1.17 C=CC[C@H](N)c1cccc(Br)[n]1 Amb24483858 [0,2,0,0,0,0|2,0,0]=4 4454 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb19929880 [0,2,0,0,0,0|1,0,0]=3 4455 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,2,0,0,0,0|1,0,0]=3 4456 B12R1.17 C=CC[C@H](N)c1cccc(Cl)c1 Amb25775422 [0,2,0,0,0,0|1,0,0]=3 4457 B12R1.17 C=CC[C@H](N)c1cccc(I)c1 Amb25784765 [0,2,0,0,0,0|1,0,0]=3 4458 B12R1.17 C=CC[C@H](N)c1cccc(N)[n]1 Amb24377199 [0,2,0,0,0,0|2,0,0]=4 4459 B12R1.17 C=CC[C@H](N)c1cccc(O)c1 Amb24487270 [0,2,0,0,0,0|1,0,0]=3 4460 B12R1.17 C=CC[C@H](O)c1cc(O)ccc1 Amb24525136 [0,2,0,0,0,0|1,0,0]=3 4461 B12R1.17 C=CC[C@H](O)c1cccc(Cl)c1 Amb25241128 [0,2,0,0,0,0|1,0,0]=3 4462 B12R1.17 C=CC[C@H](O)c1cccc(F)c1 Amb24524776 [0,2,0,0,0,0|1,0,0]=3 4463 B12R1.17 C=CNC(=O)c1cccc(Cl)c1 Amb24490413 [0,2,0,0,0,0|2,0,0]=4 4464 B12R1.17 C=COC(=O)c1cccc(O)c1 Amb18645954 [0,2,0,0,0,0|2,0,0]=4 4465 B12R1.17 CC(CC=O)c1cccc(O)c1 Amb25195457 [0,2,0,0,0,0|2,0,0]=4 4466 B12R1.17 CCCN(C)c1cccc(Br)c1 Amb25154384 [0,2,0,0,0,0|0,0,2]=4 4467 B12R1.17 CCCN(C)c1cccc(F)c1 Amb25285140 [0,2,0,0,0,0|0,0,2]=4 4468 B12R1.17 CCCN(C)c1cccc(O)c1 Amb18646357 [0,2,0,0,0,0|0,0,2]=4 4469 B12R1.17 CN(CC#C)c1cccc(Br)c1 Amb25160249 [0,2,0,0,0,0|0,0,2]=4 4470 B12R1.17 CN(CC#C)c1cccc(F)c1 Amb18788177 [0,2,0,0,0,0|0,0,2]=4 4471 B12R1.17 CN(CC#C)c1cccc(N)c1 Amb24600436 [0,2,0,0,0,0|0,0,2]=4 4472 B12R1.17 CN(CC#N)c1cccc(N)c1 Amb18952694 [0,2,0,0,0,0|1,0,1]=4 4473 B12R1.17 CN(CC=C)c1[n]c(N)cc[n]1 Amb25706062 [0,2,0,0,0,0|2,0,0]=4 4474 B12R1.17 CN(CC=C)c1cc(Cl)[n]c[n]1 Amb25149953 [0,2,0,0,0,0|2,0,0]=4 4475 B12R1.17 CN(CC=C)c1cc(N)[n]c[n]1 Amb25045682 [0,2,0,0,0,0|2,0,0]=4 4476 B12R1.17 CN(CC=C)c1cccc(O)c1 Amb25723219 [0,2,0,0,0,0|0,0,0]=2 4477 B12R1.17 CN(CC=O)c1cccc(F)c1 Amb18788558 [0,2,0,0,0,0|1,0,0]=3 4478 B12R1.17 CN(CCBr)c1cccc(Cl)c1 Amb25854316 [0,2,0,0,0,0|1,0,1]=4 4479 B12R1.17 CN(CCBr)c1cccc(F)c1 Amb22886711 [0,2,0,0,0,0|1,0,1]=4 4480 B12R1.17 CN(CCI)c1cccc(Br)c1 Amb25680335 [0,2,0,0,0,0|1,0,1]=4 4481 B12R1.17 CN(CCI)c1cccc(F)c1 Amb24732661 [0,2,0,0,0,0|1,0,1]=4 4482 B12R1.17 CN(CCI)c1cccc(O)c1 Amb24397741 [0,2,0,0,0,0|1,0,1]=4 4483 B12R1.17 CN(CCN)c1cc(Br)ccc1 Amb24525334 [0,2,0,0,0,0|1,0,1]=4 4484 B12R1.17 CN(CCN)c1cc(O)ccc1 Amb25804629 [0,2,0,0,0,0|1,0,1]=4 4485 B12R1.17 C[C@H](CC=O)c1cccc(Cl)c1 Amb24640335 [0,2,0,0,0,0|2,0,0]=4 4486 B12R1.17 Cc1cc([n]cc1)C(N)CC=C Amb24467821 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.17 Cc1cc([n]cc1)C(O)CC=C Amb24691220 [0,2,0,0,0,0|2,0,0]=4 4488 B12R1.17 Cc1cc([n]cc1)[C@@H](N)CC=C Amb24487129 [0,2,0,0,0,0|2,0,0]=4 4489 B12R1.17 Cc1cc([n]cc1)[C@H](N)CC=C Amb24411531 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.17 Cc1cc(c[n]c1)C(N)CC=C Amb24488616 [0,2,0,0,0,0|2,0,0]=4 4491 B12R1.17 Cc1cc(c[n]c1)C(O)CC=C Amb25058789 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.17 Cc1cc(cc[n]1)C(=O)CC=C Amb25089186 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.17 Cc1cc(cc[n]1)[C@@H](N)CC=C Amb24587762 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.17 Cc1cc(ccc1)C(=O)CC=O Amb18788116 [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.17 Cc1cc(ccc1)C(N)CC=C Amb18977591 [0,2,0,0,0,0|1,0,0]=3 4496 B12R1.17 Cc1cc(ccc1)C(O)CC=C Amb18177788 [0,2,0,0,0,0|1,0,0]=3 4497 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [0,2,0,0,0,0|2,0,0]=4 4498 B12R1.17 Cc1cc(ccc1)[C@@H](N)CC=C Amb25681927 [0,2,0,0,0,0|1,0,0]=3 4499 B12R1.17 Cc1cc(ccc1)[C@H](N)CC=C Amb24392927 [0,2,0,0,0,0|1,0,0]=3 4500 B12R1.17 Cc1cc[n]c([n]1)N(C)CC=C Amb24705118 [0,2,0,0,0,0|2,0,0]=4 4501 B12R1.17 Cc1cccc([n]1)C(=O)CC=C Amb25766834 [0,2,0,0,0,0|2,0,0]=4 4502 B12R1.17 Cc1cccc([n]1)[C@H](N)CC=C Amb24488530 [0,2,0,0,0,0|2,0,0]=4 4503 B12R1.17 Cc1cccc(c1)N(C)CC#C Amb18787878 [0,2,0,0,0,0|0,0,2]=4 4504 B12R1.17 Cc1cccc(c1)N(C)CC=O Amb18788187 [0,2,0,0,0,0|1,0,0]=3 4505 B12R1.17 Cc1cccc(c1)N(C)CCF Amb25057274 [0,2,0,0,0,0|1,0,1]=4 4506 B12R1.17 Cc1cccc(c1)N(C)CCI Amb25802690 [0,2,0,0,0,0|1,0,1]=4 4507 B12R1.17 ClCCN(c1cccc(c1)Br)C Amb17351920 [0,2,0,0,0,0|1,0,1]=4 4508 B12R1.17 ClCCN(c1cccc(c1)C)C Amb17335671 [0,2,0,0,0,0|1,0,1]=4 4509 B12R1.17 ClCCN(c1cccc(c1)Cl)C Amb17338056 [0,2,0,0,0,0|1,0,1]=4 4510 B12R1.17 ClCCN(c1cccc(c1)F)C Amb17335953 [0,2,0,0,0,0|1,0,1]=4 4511 B12R1.17 N#CCN(c1cccc(c1)Br)C Amb17343207 [0,2,0,0,0,0|1,0,1]=4 4512 B12R1.17 N#CCN(c1cccc(c1)C)C Amb17334502 [0,2,0,0,0,0|1,0,1]=4 4513 B12R1.17 N#CCN(c1cccc(c1)Cl)C Amb17335464 [0,2,0,0,0,0|1,0,1]=4 4514 B12R1.17 N#CCN(c1cccc(c1)F)C Amb17334604 [0,2,0,0,0,0|1,0,1]=4 4515 B12R1.17 NCCN(c1cccc(c1)Br)C Amb17059773 [0,2,0,0,0,0|1,0,1]=4 4516 B12R1.17 NCCN(c1cccc(c1)C)C Amb17059641 [0,2,0,0,0,0|1,0,1]=4 4517 B12R1.17 NCCN(c1cccc(c1)Cl)C Amb17059646 [0,2,0,0,0,0|1,0,1]=4 4518 B12R1.17 NCCN(c1cccc(c1)F)C Amb17059643 [0,2,0,0,0,0|1,0,1]=4 4519 B12R1.17 O=CCS(=O)c1cccc(Cl)c1 Amb24593348 [0,2,0,0,0,0|2,0,0]=4 4520 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [0,2,0,0,0,0|2,0,0]=4 4521 B12R1.17 OCCN(c1cccc(c1)Br)C Amb17344452 [0,2,0,0,0,0|1,0,1]=4 4522 B12R1.17 OCCN(c1cccc(c1)C)C Amb17334644 [0,2,0,0,0,0|1,0,1]=4 4523 B12R1.17 OCCN(c1cccc(c1)Cl)C Amb17335811 [0,2,0,0,0,0|1,0,1]=4 4524 B12R1.17 OCCN(c1cccc(c1)F)C Amb17334765 [0,2,0,0,0,0|1,0,1]=4 4525 B12R1.30 C=C(CNC=S)c1ccccc1 Amb25742952 [0,2,0,0,0,0|2,0,0]=4 4526 B12R1.30 C=C=CCC(Cl)c1ccccc1 Amb25700989 [0,2,0,0,0,0|1,0,0]=3 4527 B12R1.30 C=CC#CC(O)c1ccccc1 Amb24397445 [0,2,0,0,0,0|1,0,1]=4 4528 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|1,0,0]=3 4529 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,2,0,0,0,0|0,0,0]=2 4530 B12R1.30 C=CCNC(=O)c1cccnc1 Amb17794173 [0,2,0,0,0,0|1,0,0]=3 4531 B12R1.30 C=CCNC(=O)c1ccncc1 Amb1625184 [0,2,0,0,0,0|1,0,0]=3 4532 B12R1.30 C=CCNC(=O)c1cnccn1 Amb17793533 [0,2,0,0,0,0|2,0,0]=4 4533 B12R1.30 C=CCNC(=[Cl])c1ccccc1 Amb10560950 [0,2,0,0,0,0|0,0,0]=2 4534 B12R1.30 C=CCOC(=O)c1cc[n]cc1 Amb22730922 [0,2,0,0,0,0|2,0,0]=4 4535 B12R1.30 C=CC\N=C(\Cl)/c1ccccc1 Amb25154360 [0,2,0,0,0,0|0,0,1]=3 4536 B12R1.30 C=CC\N=C(\N)/c1ccccc1 Amb25761905 [0,2,0,0,0,0|0,0,1]=3 4537 B12R1.30 C=CO\N=C(\N)/c1ccccc1 Amb24512338 [0,2,0,0,0,0|1,0,1]=4 4538 B12R1.30 C=C\C=C\C(O)c1ccccc1 Amb25816538 [0,2,0,0,0,0|1,0,1]=4 4539 B12R1.30 C=C\C=N\C(=O)c1ccccc1 Amb24072845 [0,2,0,0,0,0|0,0,2]=4 4540 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|1,0,0]=3 4541 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [0,2,0,0,0,0|2,0,0]=4 4542 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [0,2,0,0,0,0|1,0,1]=4 4543 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,2,0,0,0,0|1,0,0]=3 4544 B12R1.30 CCCCN(c1ccccc1)N Amb17226670 [0,2,0,0,0,0|0,0,2]=4 4545 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,2,0,0,0,0|0,0,2]=4 4546 B12R1.30 CCCNC(=S)c1ccccc1 Amb25827093 [0,2,0,0,0,0|0,0,2]=4 4547 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,2,0,0,0,0|0,0,2]=4 4548 B12R1.30 CC\C=C/N(C)c1ccccc1 Amb24072870 [0,2,0,0,0,0|0,0,2]=4 4549 B12R1.30 CC\C=C\N(C)c1ccccc1 Amb24575001 [0,2,0,0,0,0|0,0,2]=4 4550 B12R1.30 CN(C=CC=C)c1ccccc1 Amb24092515 [0,2,0,0,0,0|0,0,1]=3 4551 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [0,2,0,0,0,0|0,0,0]=2 4552 B12R1.30 CN(\C=C/C=C)c1ccccc1 Amb25279309 [0,2,0,0,0,0|0,0,1]=3 4553 B12R1.30 CN(\C=C\C=O)c1cccc[n]1 Amb19889051 [0,2,0,0,0,0|1,0,1]=4 4554 B12R1.30 CN(c1ccccc1)CCC#C Amb10559135 [0,2,0,0,0,0|0,0,2]=4 4555 B12R1.30 CN\C=N\N(C)c1ccccc1 Amb24443088 [0,2,0,0,0,0|1,0,1]=4 4556 B12R1.30 CSCNC(=S)c1ccccc1 Amb24634347 [0,2,0,0,0,0|1,0,1]=4 4557 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,2,0,0,0,0|2,0,0]=4 4558 B12R1.30 C\C(=C/C=C\Cl)\c1ccccc1 Amb24740702 [0,2,0,0,0,0|1,0,1]=4 4559 B12R1.30 C\C(=C/CC=O)\c1ccccc1 Amb18645375 [0,2,0,0,0,0|2,0,0]=4 4560 B12R1.30 C\C(=C\C=CCl)\c1ccccc1 Amb24627050 [0,2,0,0,0,0|1,0,1]=4 4561 B12R1.30 C\C(=C\CC=O)\c1ccccc1 Amb24757521 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.30 C\C=C/CC(=O)c1ccccc1 Amb24594702 [0,2,0,0,0,0|1,0,0]=3 4563 B12R1.30 C\C=C/NC(=O)c1ccccc1 Amb24072871 [0,2,0,0,0,0|0,0,2]=4 4564 B12R1.30 C\C=C/NC(=S)c1ccccc1 Amb25273960 [0,2,0,0,0,0|0,0,2]=4 4565 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [0,2,0,0,0,0|0,0,2]=4 4566 B12R1.30 C\C=C\CC(O)c1c[n]ccc1 Amb25832725 [0,2,0,0,0,0|2,0,0]=4 4567 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,2,0,0,0,0|0,0,0]=2 4568 B12R1.30 C\C=N/NC(=O)c1ccccc1 Amb24072878 [0,2,0,0,0,0|1,0,1]=4 4569 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,2,0,0,0,0|1,0,1]=4 4570 B12R1.30 C\N=C\CC(=O)c1ccccc1 Amb25834458 [0,2,0,0,0,0|1,0,1]=4 4571 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [0,2,0,0,0,0|0,0,2]=4 4572 B12R1.30 ClCCNC(=O)c1ccccc1 Amb2414312 [0,2,0,0,0,0|1,0,1]=4 4573 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,2,0,0,0,0|1,0,1]=4 4574 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,2,0,0,0,0|1,0,1]=4 4575 B12R1.30 N=C(NCCF)c1ccccc1 Amb25351227 [0,2,0,0,0,0|1,0,1]=4 4576 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,2,0,0,0,0|1,0,1]=4 4577 B12R1.30 NOCCN(c1ccccc1)C Amb17104857 [0,2,0,0,0,0|1,0,1]=4 4578 B12R1.30 O=C(CNC=O)c1ccccc1 Amb20075907 [0,2,0,0,0,0|2,0,0]=4 4579 B12R1.30 O=C(NCCF)c1ccccc1 Amb25139529 [0,2,0,0,0,0|1,0,1]=4 4580 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,2,0,0,0,0|1,0,1]=4 4581 B12R1.30 O=C(OCC=O)c1ccccc1 Amb18645965 [0,2,0,0,0,0|2,0,0]=4 4582 B12R1.30 O=C(\C=C/C=O)c1ccccc1 Amb25359189 [0,2,0,0,0,0|1,0,1]=4 4583 B12R1.30 O=C(\C=C\C=O)c1ccccc1 Amb18645282 [0,2,0,0,0,0|1,0,1]=4 4584 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,2,0,0,0,0|1,0,0]=3 4585 B12R1.30 O=CCNC(=O)c1cccnc1 Amb17102107 [0,2,0,0,0,0|2,0,0]=4 4586 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [0,2,0,0,0,0|2,0,0]=4 4587 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,2,0,0,0,0|1,0,0]=3 4588 B12R1.30 OC(\C=C\C=O)c1ccccc1 Amb18645664 [0,2,0,0,0,0|1,0,1]=4 4589 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,2,0,0,0,0|1,0,1]=4 4590 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,2,0,0,0,0|1,0,0]=3 4591 B12R1.30 O\N=C/CC(=O)c1ccccc1 Amb25833653 [0,2,0,0,0,0|2,0,0]=4 4592 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,2,0,0,0,0|2,0,0]=4 4593 B12R1.34 C=C(C(=O)C=C)c1ccccc1 Amb24559066 [0,2,0,0,0,0|1,0,1]=4 4594 B12R1.34 C=C(C=C)C(O)c1ccccc1 Amb25334723 [0,2,0,0,0,0|1,0,1]=4 4595 B12R1.34 C=C(C=C)[C@@H](O)c1ccccc1 Amb25215362 [0,2,0,0,0,0|1,0,1]=4 4596 B12R1.34 C=CC(=O)N(c1cccnc1)C Amb16192560 [0,2,0,0,0,0|1,0,1]=4 4597 B12R1.34 C=CC(=O)[C@H](F)c1ccccc1 Amb24676844 [0,2,0,0,0,0|1,0,1]=4 4598 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [0,2,0,0,0,0|1,0,0]=3 4599 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [0,2,0,0,0,0|1,0,0]=3 4600 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [0,2,0,0,0,0|1,0,0]=3 4601 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,2,0,0,0,0|1,0,0]=3 4602 B12R1.34 C=CC(O)C(O)c1c[n]ccc1 Amb24431863 [0,2,0,0,0,0|2,0,0]=4 4603 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,2,0,0,0,0|1,0,0]=3 4604 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,2,0,0,0,0|1,0,0]=3 4605 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [0,2,0,0,0,0|1,0,0]=3 4606 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,2,0,0,0,0|1,0,0]=3 4607 B12R1.34 C=C[C@@H](O)[C@@H](O)c1c[n]ccc1 Amb25157964 [0,2,0,0,0,0|2,0,0]=4 4608 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,2,0,0,0,0|1,0,0]=3 4609 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [0,2,0,0,0,0|1,0,0]=3 4610 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [0,2,0,0,0,0|1,0,0]=3 4611 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,2,0,0,0,0|1,0,0]=3 4612 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,2,0,0,0,0|1,0,0]=3 4613 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [0,2,0,0,0,0|1,0,1]=4 4614 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,2,0,0,0,0|2,0,0]=4 4615 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,2,0,0,0,0|2,0,0]=4 4616 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,2,0,0,0,0|1,0,0]=3 4617 B12R1.34 CC(C=C)C(N)c1cccc[n]1 Amb25159295 [0,2,0,0,0,0|2,0,0]=4 4618 B12R1.34 CC(C=C)C(O)c1cc[n]cc1 Amb24688275 [0,2,0,0,0,0|2,0,0]=4 4619 B12R1.34 CC(C=C)C(O)c1ccc[n]c1 Amb25681403 [0,2,0,0,0,0|2,0,0]=4 4620 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,2,0,0,0,0|2,0,0]=4 4621 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,2,0,0,0,0|0,0,2]=4 4622 B12R1.34 CN(C=C)C(=O)c1ccccc1 Amb24096799 [0,2,0,0,0,0|2,0,0]=4 4623 B12R1.34 C[C@@H](C=C)C(=O)c1ccccc1 Amb24621322 [0,2,0,0,0,0|1,0,0]=3 4624 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [0,2,0,0,0,0|1,0,0]=3 4625 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [0,2,0,0,0,0|1,0,0]=3 4626 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [0,2,0,0,0,0|1,0,0]=3 4627 B12R1.34 C[C@@H](C=C)[C@H](O)c1cccc[n]1 Amb25306439 [0,2,0,0,0,0|2,0,0]=4 4628 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [0,2,0,0,0,0|1,0,0]=3 4629 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,2,0,0,0,0|2,0,0]=4 4630 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,2,0,0,0,0|2,0,0]=4 4631 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,2,0,0,0,0|2,0,0]=4 4632 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,2,0,0,0,0|2,0,0]=4 4633 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,2,0,0,0,0|2,0,0]=4 4634 B12R1.34 C[C@H](C=C)[C@@H](O)c1cc[n]cc1 Amb24576652 [0,2,0,0,0,0|2,0,0]=4 4635 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [0,2,0,0,0,0|1,0,0]=3 4636 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,2,0,0,0,0|2,0,0]=4 4637 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,2,0,0,0,0|1,0,0]=3 4638 B12R1.34 NC(C=O)C(=O)c1ccccc1 Amb24106087 [0,2,0,0,0,0|2,0,0]=4 4639 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,2,0,0,0,0|1,0,1]=4 4640 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,2,0,0,0,0|1,0,1]=4 4641 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,2,0,0,0,0|2,0,0]=4 4642 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,2,0,0,0,0|2,0,0]=4 4644 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,2,0,0,0,0|2,0,0]=4 4645 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,2,0,0,0,0|2,0,0]=4 4646 B12R1.39 C=CC[N+](c1ccccc1)(C)C Amb2228411 [0,2,0,0,0,0|0,0,1]=3 4647 B12R1.39 C=CC[Si](Cl)(Cl)c1ccccc1 Amb19894201 [0,2,0,0,0,0|1,0,0]=3 4648 B12R1.39 C=CC[Si](c1ccccc1)(C)C Amb2389294 [0,2,0,0,0,0|1,0,0]=3 4649 B12R1.39 CC(C)(CC=C)c1ccccc1 Amb25674101 [0,2,0,0,0,0|1,0,0]=3 4650 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,2,0,0,0,0|2,0,0]=4 4651 B12R1.39 CC(N)(CC=C)c1cc[n]cc1 Amb24405750 [0,2,0,0,0,0|2,0,0]=4 4652 B12R1.39 CC(N)(CC=C)c1cccc[n]1 Amb24555088 [0,2,0,0,0,0|2,0,0]=4 4653 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [0,2,0,0,0,0|2,0,0]=4 4654 B12R1.39 CP(=S)(CC=O)c1ccccc1 Amb25743462 [0,2,0,0,0,0|1,1,0]=4 4655 B12R1.39 C[C@@](N)(CC=C)c1cc[n]cc1 Amb24414079 [0,2,0,0,0,0|2,0,0]=4 4656 B12R1.39 C[C@@](N)(CC=C)c1ccccc1 Amb25111215 [0,2,0,0,0,0|1,0,0]=3 4657 B12R1.39 C[C@](N)(CC=C)c1c[n]ccc1 Amb25751494 [0,2,0,0,0,0|2,0,0]=4 4658 B12R1.39 C[C@](N)(CC=C)c1cccc[n]1 Amb25141113 [0,2,0,0,0,0|2,0,0]=4 4659 B12R1.39 C[Si](C)(CC=C)c1cccc[n]1 Amb22337024 [0,2,0,0,0,0|2,0,0]=4 4660 B12R1.39 C[Si](C)(CC=O)c1ccccc1 Amb25264011 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.39 O=CCS(=O)(=O)c1ccccc1 Amb19045395 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.39 [BH3-][P+](C)(CC=O)c1ccccc1 Amb24378353 [0,2,0,0,0,0|1,1,0]=4 4663 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [0,2,0,0,0,0|2,0,0]=4 4664 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,2,0,0,0,0|2,0,0]=4 4665 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,2,0,0,0,0|1,0,0]=3 4666 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,2,0,0,0,0|1,0,0]=3 4667 B12R1.107 C=C(F)CC(O)c1ccc[n]c1 Amb24343493 [0,2,0,0,0,0|2,0,0]=4 4668 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,2,0,0,0,0|1,0,0]=3 4669 B12R1.107 CC(=C)CC(=O)c1cc[n]cc1 Amb18563517 [0,2,0,0,0,0|2,0,0]=4 4670 B12R1.107 CC(=C)CC(=O)c1ccc[n]c1 Amb18563516 [0,2,0,0,0,0|2,0,0]=4 4671 B12R1.107 CC(=C)CC(=O)c1cccc[n]1 Amb18563515 [0,2,0,0,0,0|2,0,0]=4 4672 B12R1.107 CC(=C)CC(=O)c1ccccc1 Amb18563490 [0,2,0,0,0,0|1,0,0]=3 4673 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,2,0,0,0,0|1,0,0]=3 4674 B12R1.107 CC(=C)CC(O)c1cc[n]cc1 Amb24439149 [0,2,0,0,0,0|2,0,0]=4 4675 B12R1.107 CC(=C)CC(O)c1ccc[n]c1 Amb25083900 [0,2,0,0,0,0|2,0,0]=4 4676 B12R1.107 CC(=C)CC(O)c1cccc[n]1 Amb25675378 [0,2,0,0,0,0|2,0,0]=4 4677 B12R1.107 CC(=C)CN(C)c1[n]ccc[n]1 Amb24466684 [0,2,0,0,0,0|2,0,0]=4 4678 B12R1.107 CC(=C)CN(C)c1cc[n]cc1 Amb24459023 [0,2,0,0,0,0|1,0,0]=3 4679 B12R1.107 CC(=C)CN(C)c1cccc[n]1 Amb24619418 [0,2,0,0,0,0|1,0,0]=3 4680 B12R1.107 CC(=C)C[C@@H](N)c1ccc[n]c1 Amb24612157 [0,2,0,0,0,0|2,0,0]=4 4681 B12R1.107 CC(=C)C[C@H](N)c1cccc[n]1 Amb24629000 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,2,0,0,0,0|1,0,0]=3 4683 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,2,0,0,0,0|1,0,0]=3 4684 B12R1.107 CC(=C)NC(=O)c1ccccc1 Amb24096681 [0,2,0,0,0,0|2,0,0]=4 4685 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,2,0,0,0,0|2,0,0]=4 4686 B12R1.107 CC(CN(c1ccccc1)C)C Amb17232437 [0,2,0,0,0,0|0,0,2]=4 4687 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,2,0,0,0,0|0,0,2]=4 4688 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,2,0,0,0,0|0,0,2]=4 4689 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,2,0,0,0,0|0,0,2]=4 4690 B12R1.107 CC(CN(c1ccccc1)N)C Amb17226667 [0,2,0,0,0,0|0,0,2]=4 4691 B12R1.107 CC(Cl)CN(C)c1ccccc1 Amb24711498 [0,2,0,0,0,0|0,0,2]=4 4692 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.107 CN(CC(=C)Br)c1cccc[n]1 Amb24397864 [0,2,0,0,0,0|1,0,0]=3 4694 B12R1.107 CN(CC(Cl)Cl)c1ccccc1 Amb24351871 [0,2,0,0,0,0|1,0,1]=4 4695 B12R1.107 CN(CC(F)F)c1ccccc1 Amb25079937 [0,2,0,0,0,0|1,0,1]=4 4696 B12R1.107 CN(CC(N)=O)c1cccc[n]1 Amb25686738 [0,2,0,0,0,0|2,0,0]=4 4697 B12R1.107 CN(CC(O)=O)c1ccc[n]c1 Amb18268673 [0,2,0,0,0,0|2,0,0]=4 4698 B12R1.107 CN(CC(O)=O)c1cccc[n]1 Amb22275945 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.107 CN(c1ccccc1)CC(=C)C Amb10571185 [0,2,0,0,0,0|0,0,0]=2 4700 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [0,2,0,0,0,0|1,0,0]=3 4701 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,2,0,0,0,0|1,0,0]=3 4702 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,2,0,0,0,0|1,1,0]=4 4703 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,2,0,0,0,0|0,0,2]=4 4704 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,2,0,0,0,0|0,0,2]=4 4705 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,2,0,0,0,0|2,0,0]=4 4706 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,2,0,0,0,0|2,0,0]=4 4707 B12R1.107 NC(=N)CC(=S)c1ccccc1 Amb24692832 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [0,2,0,0,0,0|1,0,0]=3 4709 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [0,2,0,0,0,0|1,1,0]=4 4713 B12R1.107 NC(=S)CC(=N)c1ccccc1 Amb25337793 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|1,0,0]=3 4719 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [0,2,0,0,0,0|2,0,0]=4 4720 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,2,0,0,0,0|2,0,0]=4 4721 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|2,0,0]=4 4722 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,2,0,0,0,0|2,0,0]=4 4723 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [0,2,0,0,0,0|2,0,0]=4 4728 B12R1.308 C=CCC(=O)c1[n]cccc1Cl Amb24659106 [0,2,0,0,0,0|2,0,0]=4 4729 B12R1.308 C=CCC(=O)c1cc[n]cc1F Amb25039117 [0,2,0,0,0,0|2,0,0]=4 4730 B12R1.308 C=CCC(=O)c1ccccc1Br Amb25849337 [0,2,0,0,0,0|1,0,0]=3 4731 B12R1.308 C=CCC(=O)c1ccccc1C Amb17334496 [0,2,0,0,0,0|1,0,0]=3 4732 B12R1.308 C=CCC(=O)c1ccccc1Cl Amb17335455 [0,2,0,0,0,0|1,0,0]=3 4733 B12R1.308 C=CCC(=O)c1ccccc1F Amb17334599 [0,2,0,0,0,0|1,0,0]=3 4734 B12R1.308 C=CCC(=O)c1ccccc1O Amb24364098 [0,2,0,0,0,0|1,0,0]=3 4735 B12R1.308 C=CCC(N)c1[n]cccc1Br Amb25049232 [0,2,0,0,0,0|2,0,0]=4 4736 B12R1.308 C=CCC(N)c1[n]cccc1Cl Amb25325760 [0,2,0,0,0,0|2,0,0]=4 4737 B12R1.308 C=CCC(N)c1[n]cccc1N Amb24488578 [0,2,0,0,0,0|2,0,0]=4 4738 B12R1.308 C=CCC(N)c1c[n]ccc1N Amb24763611 [0,2,0,0,0,0|2,0,0]=4 4739 B12R1.308 C=CCC(N)c1cc[n]cc1Cl Amb24394156 [0,2,0,0,0,0|2,0,0]=4 4740 B12R1.308 C=CCC(N)c1cc[n]cc1F Amb24715789 [0,2,0,0,0,0|2,0,0]=4 4741 B12R1.308 C=CCC(N)c1cc[n]cc1N Amb25112027 [0,2,0,0,0,0|2,0,0]=4 4742 B12R1.308 C=CCC(N)c1ccc[n]c1Cl Amb24609897 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.308 C=CCC(N)c1ccc[n]c1F Amb24460303 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.308 C=CCC(N)c1ccc[n]c1N Amb25187471 [0,2,0,0,0,0|2,0,0]=4 4745 B12R1.308 C=CCC(N)c1ccc[n]c1O Amb25187684 [0,2,0,0,0,0|2,0,0]=4 4746 B12R1.308 C=CCC(N)c1ccc[n]c1S Amb24487125 [0,2,0,0,0,0|2,0,0]=4 4747 B12R1.308 C=CCC(N)c1ccccc1Br Amb18293502 [0,2,0,0,0,0|1,0,0]=3 4748 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,2,0,0,0,0|1,0,0]=3 4749 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,2,0,0,0,0|1,0,0]=3 4750 B12R1.308 C=CCC(N)c1ccccc1I Amb25377094 [0,2,0,0,0,0|1,0,0]=3 4751 B12R1.308 C=CCC(N)c1ccccc1O Amb25261429 [0,2,0,0,0,0|1,0,0]=3 4752 B12R1.308 C=CCC(O)c1[n]cccc1Br Amb24451200 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.308 C=CCC(O)c1cc[n]cc1Cl Amb25756911 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,2,0,0,0,0|1,0,0]=3 4755 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,2,0,0,0,0|1,0,0]=3 4756 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,2,0,0,0,0|1,0,0]=3 4757 B12R1.308 C=CCC(O)c1ccccc1I Amb25775871 [0,2,0,0,0,0|1,0,0]=3 4758 B12R1.308 C=CCC(O)c1ccccc1O Amb18646046 [0,2,0,0,0,0|1,0,0]=3 4759 B12R1.308 C=CC[C@@H](N)c1[n]cccc1N Amb25360102 [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.308 C=CC[C@@H](N)c1[n]cccc1O Amb25859319 [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.308 C=CC[C@@H](N)c1cc[n]cc1Br Amb24383040 [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.308 C=CC[C@@H](N)c1ccc[n]c1Cl Amb24699147 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.308 C=CC[C@@H](N)c1ccc[n]c1F Amb24488521 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.308 C=CC[C@@H](N)c1ccc[n]c1N Amb24465163 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.308 C=CC[C@@H](N)c1ccc[n]c1O Amb25189388 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.308 C=CC[C@@H](N)c1ccc[n]c1S Amb25214658 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb19889592 [0,2,0,0,0,0|1,0,0]=3 4768 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb22831179 [0,2,0,0,0,0|1,0,0]=3 4769 B12R1.308 C=CC[C@@H](N)c1ccccc1F Amb22831408 [0,2,0,0,0,0|1,0,0]=3 4770 B12R1.308 C=CC[C@@H](N)c1ccccc1N Amb25368389 [0,2,0,0,0,0|1,0,0]=3 4771 B12R1.308 C=CC[C@@H](O)c1ccccc1Cl Amb24372071 [0,2,0,0,0,0|1,0,0]=3 4772 B12R1.308 C=CC[C@H](N)c1[n]cccc1Cl Amb24487130 [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.308 C=CC[C@H](N)c1[n]cccc1F Amb25141962 [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.308 C=CC[C@H](N)c1[n]cccc1O Amb24763683 [0,2,0,0,0,0|2,0,0]=4 4775 B12R1.308 C=CC[C@H](N)c1c[n]ccc1Cl Amb24761475 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.308 C=CC[C@H](N)c1cc[n]cc1F Amb24488528 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.308 C=CC[C@H](N)c1cc[n]cc1N Amb24341765 [0,2,0,0,0,0|2,0,0]=4 4778 B12R1.308 C=CC[C@H](N)c1cc[n]cc1O Amb24470688 [0,2,0,0,0,0|2,0,0]=4 4779 B12R1.308 C=CC[C@H](N)c1ccc[n]c1Br Amb24532677 [0,2,0,0,0,0|2,0,0]=4 4780 B12R1.308 C=CC[C@H](N)c1ccc[n]c1F Amb24763684 [0,2,0,0,0,0|2,0,0]=4 4781 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb19889591 [0,2,0,0,0,0|1,0,0]=3 4782 B12R1.308 C=CC[C@H](N)c1ccccc1N Amb25138190 [0,2,0,0,0,0|1,0,0]=3 4783 B12R1.308 C=CC[C@H](N)c1ccccc1S Amb24460315 [0,2,0,0,0,0|1,0,0]=3 4784 B12R1.308 C=CC[C@H](O)c1ccccc1Cl Amb24534332 [0,2,0,0,0,0|1,0,0]=3 4785 B12R1.308 C=CC[C@H](O)c1ccccc1O Amb24497366 [0,2,0,0,0,0|1,0,0]=3 4786 B12R1.308 C=CC[C@H](O)c1ccccc1S Amb24608088 [0,2,0,0,0,0|1,0,0]=3 4787 B12R1.308 C=COC(=O)c1ccccc1Cl Amb22277131 [0,2,0,0,0,0|2,0,0]=4 4788 B12R1.308 CC(CC=O)c1ccccc1Cl Amb18648717 [0,2,0,0,0,0|2,0,0]=4 4789 B12R1.308 CC(CC=O)c1ccccc1F Amb25253611 [0,2,0,0,0,0|2,0,0]=4 4790 B12R1.308 CCCN(C)c1ccccc1Br Amb25306279 [0,2,0,0,0,0|0,0,2]=4 4791 B12R1.308 CCCN(C)c1ccccc1F Amb25345830 [0,2,0,0,0,0|0,0,2]=4 4792 B12R1.308 CN(CC#C)c1ccccc1F Amb18788176 [0,2,0,0,0,0|0,0,2]=4 4793 B12R1.308 CN(CC#C)c1ccccc1I Amb24632856 [0,2,0,0,0,0|0,0,2]=4 4794 B12R1.308 CN(CC#C)c1ccccc1N Amb25299537 [0,2,0,0,0,0|0,0,2]=4 4795 B12R1.308 CN(CC#C)c1ccccc1O Amb24577764 [0,2,0,0,0,0|0,0,2]=4 4796 B12R1.308 CN(CC#N)c1ccccc1N Amb18957837 [0,2,0,0,0,0|1,0,1]=4 4797 B12R1.308 CN(CC=C)c1[n]c[n]cc1I Amb25103015 [0,2,0,0,0,0|2,0,0]=4 4798 B12R1.308 CN(CC=C)c1[n]c[n]cc1N Amb25232280 [0,2,0,0,0,0|2,0,0]=4 4799 B12R1.308 CN(CC=C)c1[n]cc[n]c1N Amb25063500 [0,2,0,0,0,0|2,0,0]=4 4800 B12R1.308 CN(CC=C)c1c[n]ccc1N Amb24522732 [0,2,0,0,0,0|1,0,0]=3 4801 B12R1.308 CN(CC=C)c1cc[n]cc1Br Amb25131323 [0,2,0,0,0,0|1,0,0]=3 4802 B12R1.308 CN(CC=C)c1ccccc1F Amb24474650 [0,2,0,0,0,0|0,0,0]=2 4803 B12R1.308 CN(CC=C)c1ccccc1O Amb25674265 [0,2,0,0,0,0|0,0,0]=2 4804 B12R1.308 CN(CC=O)c1ccccc1F Amb18788557 [0,2,0,0,0,0|1,0,0]=3 4805 B12R1.308 CN(CCBr)c1ccccc1F Amb24454501 [0,2,0,0,0,0|1,0,1]=4 4806 B12R1.308 CN(CCI)c1ccccc1F Amb25344514 [0,2,0,0,0,0|1,0,1]=4 4807 B12R1.308 CN(CCO)c1ccccc1I Amb25307387 [0,2,0,0,0,0|1,0,1]=4 4808 B12R1.308 CN(CCS)c1ccccc1F Amb24577221 [0,2,0,0,0,0|1,0,1]=4 4809 B12R1.308 C[C@H](CC=O)c1ccccc1Cl Amb24537615 [0,2,0,0,0,0|2,0,0]=4 4810 B12R1.308 C\C(=C\C=C)\c1ccccc1N Amb24379609 [0,2,0,0,0,0|1,0,1]=4 4811 B12R1.308 Cc1[n]cccc1C(N)CC=C Amb24488611 [0,2,0,0,0,0|2,0,0]=4 4812 B12R1.308 Cc1[n]cccc1C(O)CC=C Amb24567538 [0,2,0,0,0,0|2,0,0]=4 4813 B12R1.308 Cc1[n]cccc1[C@H](N)CC=C Amb24488628 [0,2,0,0,0,0|2,0,0]=4 4814 B12R1.308 Cc1c[n]ccc1C(N)CC=C Amb25667257 [0,2,0,0,0,0|2,0,0]=4 4815 B12R1.308 Cc1cc[n]cc1C(=O)CC=C Amb25333831 [0,2,0,0,0,0|2,0,0]=4 4816 B12R1.308 Cc1cc[n]cc1[C@@H](N)CC=C Amb25034709 [0,2,0,0,0,0|2,0,0]=4 4817 B12R1.308 Cc1ccc[n]c1C(=O)CC=C Amb18797970 [0,2,0,0,0,0|2,0,0]=4 4818 B12R1.308 Cc1ccc[n]c1C(N)CC=C Amb18981745 [0,2,0,0,0,0|2,0,0]=4 4819 B12R1.308 Cc1ccc[n]c1C(O)CC=C Amb18798194 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.308 Cc1ccc[n]c1[C@@H](N)CC=C Amb24487264 [0,2,0,0,0,0|2,0,0]=4 4821 B12R1.308 Cc1ccc[n]c1[C@H](N)CC=C Amb25189599 [0,2,0,0,0,0|2,0,0]=4 4822 B12R1.308 Cc1ccccc1C(Cl)CC=C Amb25044767 [0,2,0,0,0,0|1,0,0]=3 4823 B12R1.308 Cc1ccccc1C(N)CC=C Amb18292097 [0,2,0,0,0,0|1,0,0]=3 4824 B12R1.308 Cc1ccccc1C(O)CC=C Amb18177787 [0,2,0,0,0,0|1,0,0]=3 4825 B12R1.308 Cc1ccccc1N(C)CC#C Amb18787877 [0,2,0,0,0,0|0,0,2]=4 4826 B12R1.308 Cc1ccccc1N(C)CC=O Amb18788186 [0,2,0,0,0,0|1,0,0]=3 4827 B12R1.308 Cc1ccccc1N(C)CCBr Amb24418265 [0,2,0,0,0,0|1,0,1]=4 4828 B12R1.308 ClCCN(c1ccccc1Br)C Amb17351919 [0,2,0,0,0,0|1,0,1]=4 4829 B12R1.308 ClCCN(c1ccccc1C)C Amb17335670 [0,2,0,0,0,0|1,0,1]=4 4830 B12R1.308 ClCCN(c1ccccc1Cl)C Amb17338055 [0,2,0,0,0,0|1,0,1]=4 4831 B12R1.308 ClCCN(c1ccccc1F)C Amb17335951 [0,2,0,0,0,0|1,0,1]=4 4832 B12R1.308 N#CCN(c1ccccc1Br)C Amb17343206 [0,2,0,0,0,0|1,0,1]=4 4833 B12R1.308 N#CCN(c1ccccc1C)C Amb17334501 [0,2,0,0,0,0|1,0,1]=4 4834 B12R1.308 N#CCN(c1ccccc1Cl)C Amb17335463 [0,2,0,0,0,0|1,0,1]=4 4835 B12R1.308 N#CCN(c1ccccc1F)C Amb17334602 [0,2,0,0,0,0|1,0,1]=4 4836 B12R1.308 NCCN(c1ccccc1Br)C Amb17059772 [0,2,0,0,0,0|1,0,1]=4 4837 B12R1.308 NCCN(c1ccccc1C)C Amb17059640 [0,2,0,0,0,0|1,0,1]=4 4838 B12R1.308 NCCN(c1ccccc1Cl)C Amb17059645 [0,2,0,0,0,0|1,0,1]=4 4839 B12R1.308 NCCN(c1ccccc1F)C Amb17059642 [0,2,0,0,0,0|1,0,1]=4 4840 B12R1.308 Nc1ccccc1C(=O)CC=O Amb25299151 [0,2,0,0,0,0|2,0,0]=4 4841 B12R1.308 O=CCS(=O)c1ccccc1F Amb25273429 [0,2,0,0,0,0|2,0,0]=4 4842 B12R1.308 OCCN(c1ccccc1Br)C Amb17344451 [0,2,0,0,0,0|1,0,1]=4 4843 B12R1.308 OCCN(c1ccccc1C)C Amb17334643 [0,2,0,0,0,0|1,0,1]=4 4844 B12R1.308 OCCN(c1ccccc1Cl)C Amb17335810 [0,2,0,0,0,0|1,0,1]=4 4845 B12R1.308 OCCN(c1ccccc1F)C Amb17334763 [0,2,0,0,0,0|1,0,1]=4 4846 B12R1.308 Oc1ccccc1C(=O)CC=O Amb18645953 [0,2,0,0,0,0|2,0,0]=4 4847 B12R1.25 C#CCNc1cccc(Br)c1Cl Amb25728842 [0,2,0,0,0,0|0,0,2]=4 4848 B12R1.25 C#CCNc1cccc(Cl)c1Cl Amb19047843 [0,2,0,0,0,0|0,0,2]=4 4849 B12R1.25 C#CCNc1cccc(Cl)c1F Amb19057367 [0,2,0,0,0,0|0,0,2]=4 4850 B12R1.25 C#CCNc1cccc(F)c1F Amb18792888 [0,2,0,0,0,0|0,0,2]=4 4851 B12R1.25 C=CCCN1C=CC=C(Br)C1=O Amb25128112 [0,2,0,0,0,0|2,0,0]=4 4852 B12R1.25 C=CCCc1cccc(Cl)c1Cl Amb25363988 [0,2,0,0,0,0|1,0,0]=3 4853 B12R1.25 C=CCCc1cccc(Cl)c1F Amb24411459 [0,2,0,0,0,0|1,0,0]=3 4854 B12R1.25 C=CCCc1cccc(F)c1F Amb24663845 [0,2,0,0,0,0|1,0,0]=3 4855 B12R1.25 C=CCNC=1C=NNC(=O)C1Br Amb25354953 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.25 C=CCNC=1N=CNC(=O)C1Br Amb25287836 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.25 C=CCNC=1N=CNC(=O)C1I Amb25755553 [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.25 C=CCNc1[n]c[n]c(Cl)c1Br Amb24472647 [0,2,0,0,0,0|2,0,0]=4 4859 B12R1.25 C=CCNc1[n]c[n]c(N)c1Cl Amb24758643 [0,2,0,0,0,0|2,0,0]=4 4860 B12R1.25 C=CCNc1cccc(Cl)c1Br Amb25136516 [0,2,0,0,0,0|0,0,0]=2 4861 B12R1.25 C=CCNc1cccc(Cl)c1F Amb19058325 [0,2,0,0,0,0|0,0,0]=2 4862 B12R1.25 C=CCNc1cccc(Cl)c1N Amb24377340 [0,2,0,0,0,0|0,0,0]=2 4863 B12R1.25 C=CCNc1cccc(F)c1F Amb18295639 [0,2,0,0,0,0|0,0,0]=2 4864 B12R1.25 C=CCNc1cccc(F)c1N Amb18992175 [0,2,0,0,0,0|0,0,0]=2 4865 B12R1.25 C=CCOc1[n]ccc(Br)c1Cl Amb25243804 [0,2,0,0,0,0|2,0,0]=4 4866 B12R1.25 C=CCOc1[n]ccc(O)c1Cl Amb25379469 [0,2,0,0,0,0|2,0,0]=4 4867 B12R1.25 C=CCOc1cccc(Br)c1F Amb22896683 [0,2,0,0,0,0|1,0,0]=3 4868 B12R1.25 C=CCOc1cccc(F)c1I Amb25669714 [0,2,0,0,0,0|1,0,0]=3 4869 B12R1.25 C=CCOc1cccc(N)c1Br Amb24531422 [0,2,0,0,0,0|1,0,0]=3 4870 B12R1.25 C=CCOc1cccc(N)c1Cl Amb25821654 [0,2,0,0,0,0|1,0,0]=3 4871 B12R1.25 C=CCOc1cccc(O)c1O Amb18646459 [0,2,0,0,0,0|1,0,0]=3 4872 B12R1.25 C=CCSc1cccc(Br)c1N Amb25697794 [0,2,0,0,0,0|1,0,0]=3 4873 B12R1.25 C=CCSc1cccc(Cl)c1N Amb24461862 [0,2,0,0,0,0|1,0,0]=3 4874 B12R1.25 C=CCSc1cccc(F)c1N Amb24461861 [0,2,0,0,0,0|1,0,0]=3 4875 B12R1.25 CC1=CC=CN(CCC=C)C1=O Amb25667678 [0,2,0,0,0,0|2,0,0]=4 4876 B12R1.25 CCCNc1cccc(Cl)c1N Amb24377739 [0,2,0,0,0,0|0,0,2]=4 4877 B12R1.25 CCCNc1cccc(F)c1F Amb18793935 [0,2,0,0,0,0|0,0,2]=4 4878 B12R1.25 CCCNc1cccc(F)c1N Amb18968033 [0,2,0,0,0,0|0,0,2]=4 4879 B12R1.25 CN1C=CN=C(NCC=C)C1=O Amb18999983 [0,2,0,0,0,0|2,0,0]=4 4880 B12R1.25 Cc1[n]c[n]c(NCC=C)c1F Amb25160079 [0,2,0,0,0,0|2,0,0]=4 4881 B12R1.25 Cc1c(Br)cccc1NCCC Amb24420962 [0,2,0,0,0,0|0,0,2]=4 4882 B12R1.25 Cc1c(Cl)cccc1CCC=O Amb18564226 [0,2,0,0,0,0|2,0,0]=4 4883 B12R1.25 Cc1c(Cl)cccc1NCC#C Amb18186522 [0,2,0,0,0,0|0,0,2]=4 4884 B12R1.25 Cc1c(Cl)cccc1NCC=C Amb18796545 [0,2,0,0,0,0|0,0,0]=2 4885 B12R1.25 Cc1c(Cl)cccc1SCC=C Amb25684672 [0,2,0,0,0,0|1,0,0]=3 4886 B12R1.25 Cc1c(F)cccc1CCC=O Amb25299267 [0,2,0,0,0,0|2,0,0]=4 4887 B12R1.25 Cc1c(F)cccc1NCC#C Amb18792477 [0,2,0,0,0,0|0,0,2]=4 4888 B12R1.25 Cc1c(F)cccc1NCC#N Amb18955814 [0,2,0,0,0,0|1,0,1]=4 4889 B12R1.25 Cc1c(F)cccc1NCC=C Amb18792658 [0,2,0,0,0,0|0,0,0]=2 4890 B12R1.25 Cc1c(F)cccc1NCCC Amb18798862 [0,2,0,0,0,0|0,0,2]=4 4891 B12R1.25 Cc1c(I)cccc1NCC=C Amb24739351 [0,2,0,0,0,0|0,0,0]=2 4892 B12R1.25 Cc1c(N)cccc1NCC=C Amb19002502 [0,2,0,0,0,0|0,0,0]=2 4893 B12R1.25 Cc1c(N)cccc1NCCC Amb18303020 [0,2,0,0,0,0|0,0,2]=4 4894 B12R1.25 Cc1c(N)cccc1NCCF Amb25799841 [0,2,0,0,0,0|1,0,1]=4 4895 B12R1.25 Cc1c(N)cccc1NCCO Amb19002458 [0,2,0,0,0,0|1,0,1]=4 4896 B12R1.25 Cc1c(N)cccc1OCC=C Amb18991655 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.25 Cc1c(N)cccc1SCC=C Amb24627531 [0,2,0,0,0,0|1,0,0]=3 4898 B12R1.25 Cc1c(NCC=C)cccc1C Amb17306011 [0,2,0,0,0,0|0,0,0]=2 4899 B12R1.25 Cc1c(NCCCl)cccc1C Amb17335666 [0,2,0,0,0,0|1,0,1]=4 4900 B12R1.25 Cc1c(NCCN)cccc1C Amb17091054 [0,2,0,0,0,0|1,0,1]=4 4901 B12R1.25 Cc1c(NCCN)cccc1Cl Amb17091057 [0,2,0,0,0,0|1,0,1]=4 4902 B12R1.25 Cc1c(cccc1Br)NCCN Amb24654407 [0,2,0,0,0,0|1,0,1]=4 4903 B12R1.25 Cc1c(cccc1Br)NCCO Amb25144864 [0,2,0,0,0,0|1,0,1]=4 4904 B12R1.25 Cc1c(cccc1Cl)NCCF Amb25744159 [0,2,0,0,0,0|1,0,1]=4 4905 B12R1.25 Cc1c(cccc1F)NCCN Amb18251978 [0,2,0,0,0,0|1,0,1]=4 4906 B12R1.25 Cc1c(cccc1F)NCCO Amb18980394 [0,2,0,0,0,0|1,0,1]=4 4907 B12R1.25 Cc1c(cccc1I)NCCF Amb25124421 [0,2,0,0,0,0|1,0,1]=4 4908 B12R1.25 Cc1c(cccc1N)NCCN Amb19002501 [0,2,0,0,0,0|1,0,1]=4 4909 B12R1.25 Cc1cc[n]c(NCC=C)c1Br Amb25298794 [0,2,0,0,0,0|1,0,0]=3 4910 B12R1.25 Cc1cccc(CCC=O)c1Br Amb24532658 [0,2,0,0,0,0|2,0,0]=4 4911 B12R1.25 Cc1cccc(CCC=O)c1C Amb18563554 [0,2,0,0,0,0|2,0,0]=4 4912 B12R1.25 Cc1cccc(CCC=O)c1F Amb24093002 [0,2,0,0,0,0|2,0,0]=4 4913 B12R1.25 Cc1cccc(NCC#C)c1C Amb18800151 [0,2,0,0,0,0|0,0,2]=4 4914 B12R1.25 Cc1cccc(NCC#C)c1F Amb24493593 [0,2,0,0,0,0|0,0,2]=4 4915 B12R1.25 Cc1cccc(NCC#N)c1Br Amb25138485 [0,2,0,0,0,0|1,0,1]=4 4916 B12R1.25 Cc1cccc(NCC#N)c1F Amb24343755 [0,2,0,0,0,0|1,0,1]=4 4917 B12R1.25 Cc1cccc(NCC#N)c1N Amb25039193 [0,2,0,0,0,0|1,0,1]=4 4918 B12R1.25 Cc1cccc(NCC=C)c1F Amb24692415 [0,2,0,0,0,0|0,0,0]=2 4919 B12R1.25 Cc1cccc(NCCC)c1Cl Amb25816695 [0,2,0,0,0,0|0,0,2]=4 4920 B12R1.25 Cc1cccc(NCCF)c1Br Amb25108876 [0,2,0,0,0,0|1,0,1]=4 4921 B12R1.25 Cc1cccc(NCCN)c1F Amb25684079 [0,2,0,0,0,0|1,0,1]=4 4922 B12R1.25 Cc1cccc(NCCO)c1Br Amb25046066 [0,2,0,0,0,0|1,0,1]=4 4923 B12R1.25 Cc1cccc(NCCO)c1Cl Amb24652065 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.25 Cc1cccc(OCC=C)c1C Amb24342097 [0,2,0,0,0,0|1,0,0]=3 4925 B12R1.25 Cc1cccc(OCC=C)c1Cl Amb24458366 [0,2,0,0,0,0|1,0,0]=3 4926 B12R1.25 Cc1cccc(OCC=C)c1N Amb18991656 [0,2,0,0,0,0|1,0,0]=3 4927 B12R1.25 Cc1ccnc(c1N)NCC=C Amb17213637 [0,2,0,0,0,0|1,0,0]=3 4928 B12R1.25 ClCCNc1cccc(c1C)Cl Amb17338051 [0,2,0,0,0,0|1,0,1]=4 4929 B12R1.25 ClCCNc1cccc(c1Cl)Cl Amb17343166 [0,2,0,0,0,0|1,0,1]=4 4930 B12R1.25 FCCNc1cccc(Cl)c1Cl Amb25108906 [0,2,0,0,0,0|1,0,1]=4 4931 B12R1.25 Fc1c(Cl)cccc1NCCF Amb24693402 [0,2,0,0,0,0|1,0,1]=4 4932 B12R1.25 N#CCNc1cccc(Cl)c1Br Amb25687223 [0,2,0,0,0,0|1,0,1]=4 4933 B12R1.25 N#CCNc1cccc(F)c1F Amb18951258 [0,2,0,0,0,0|1,0,1]=4 4934 B12R1.25 N#CCNc1cccc(F)c1I Amb24425921 [0,2,0,0,0,0|1,0,1]=4 4935 B12R1.25 N=CCCc1cccc(O)c1O Amb25713589 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.25 NCCNc1cccc(Cl)c1F Amb18909782 [0,2,0,0,0,0|1,0,1]=4 4937 B12R1.25 NCCNc1cccc(F)c1F Amb18908891 [0,2,0,0,0,0|1,0,1]=4 4938 B12R1.25 NCCNc1cccc(F)c1I Amb25723571 [0,2,0,0,0,0|1,0,1]=4 4939 B12R1.25 NCCNc1cccc(c1Cl)Cl Amb17091084 [0,2,0,0,0,0|1,0,1]=4 4940 B12R1.25 Nc1c(Br)cccc1NCCN Amb25071760 [0,2,0,0,0,0|1,0,1]=4 4941 B12R1.25 Nc1c(Cl)cccc1CCC=O Amb24743856 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.25 Nc1c(Cl)cccc1NCCN Amb24671070 [0,2,0,0,0,0|1,0,1]=4 4943 B12R1.25 Nc1c(F)cccc1NCCN Amb18991513 [0,2,0,0,0,0|1,0,1]=4 4944 B12R1.25 Nc1c(I)cccc1CCC=O Amb25249914 [0,2,0,0,0,0|2,0,0]=4 4945 B12R1.25 Nc1c(S)cccc1CCC=O Amb25242712 [0,2,0,0,0,0|2,0,0]=4 4946 B12R1.25 Nc1c(cccc1Br)NCCF Amb24359399 [0,2,0,0,0,0|1,0,1]=4 4947 B12R1.25 Nc1c(cccc1Cl)NCCF Amb25669798 [0,2,0,0,0,0|1,0,1]=4 4948 B12R1.25 Nc1c(cccc1F)NCCO Amb18968044 [0,2,0,0,0,0|1,0,1]=4 4949 B12R1.25 O=CCCc1cccc(Br)c1Cl Amb24483778 [0,2,0,0,0,0|2,0,0]=4 4950 B12R1.25 O=CCCc1cccc(Br)c1F Amb25739079 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.25 O=CCCc1cccc(Br)c1S Amb25270364 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.25 O=CCCc1cccc(Cl)c1Br Amb25856957 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.25 O=CCCc1cccc(Cl)c1Cl Amb18066576 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.25 O=CCCc1cccc(F)c1F Amb18801722 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.25 O=CCCc1cccc(I)c1F Amb25148788 [0,2,0,0,0,0|2,0,0]=4 4956 B12R1.25 O=CCOc1cccc(Cl)c1F Amb25849144 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.25 O=CCOc1cccc(F)c1F Amb18789654 [0,2,0,0,0,0|2,0,0]=4 4958 B12R1.25 OCCNc1cccc(Br)c1Cl Amb25787091 [0,2,0,0,0,0|1,0,1]=4 4959 B12R1.25 OCCNc1cccc(Cl)c1Br Amb24271233 [0,2,0,0,0,0|1,0,1]=4 4960 B12R1.25 OCCNc1cccc(F)c1Cl Amb25675434 [0,2,0,0,0,0|1,0,1]=4 4961 B12R1.25 OCCNc1cccc(F)c1F Amb18972086 [0,2,0,0,0,0|1,0,1]=4 4962 B12R1.25 OCCNc1cccc(F)c1I Amb24365727 [0,2,0,0,0,0|1,0,1]=4 4963 B12R1.25 Oc1c(Br)cccc1CCC=O Amb24728306 [0,2,0,0,0,0|2,0,0]=4 4964 B12R1.25 Oc1cccc(CCC=O)c1F Amb25831101 [0,2,0,0,0,0|2,0,0]=4 4965 B12R1.121 C#CCNc1ccccc1C=O Amb24070201 [0,2,0,0,0,0|0,0,2]=4 4966 B12R1.121 C#CCNc1ccccc1CO Amb24379316 [0,2,0,0,0,0|0,0,2]=4 4967 B12R1.121 C#Cc1ccccc1CCC=O Amb24422382 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.121 C=CCCc1ccccc1CO Amb24069012 [0,2,0,0,0,0|1,0,0]=3 4969 B12R1.121 C=CCNc1[n]cc[n]c1C#N Amb18300101 [0,2,0,0,0,0|2,0,0]=4 4970 B12R1.121 C=CCNc1ccc[n]c1C#N Amb25050107 [0,2,0,0,0,0|1,0,0]=3 4971 B12R1.121 C=CCNc1ccccc1C#C Amb24466928 [0,2,0,0,0,0|0,0,0]=2 4972 B12R1.121 C=CCNc1ncccc1CN Amb17232430 [0,2,0,0,0,0|1,0,0]=3 4973 B12R1.121 C=CCNc1ncccc1CO Amb17232477 [0,2,0,0,0,0|1,0,0]=3 4974 B12R1.121 C=CCOc1[n]cccc1C=O Amb23454864 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.121 C=CCOc1c[n]ccc1C#N Amb24468528 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.121 C=CCOc1cc[n]cc1C#N Amb24764127 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.121 C=CCOc1ccccc1C=O Amb1211891 [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.121 C=CCOc1ccccc1CO Amb1110020 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.121 C=CCOc1ccccc1NN Amb25694443 [0,2,0,0,0,0|1,0,0]=3 4980 B12R1.121 C=CCOc1ccccc1[Zn]Br Amb22897941 [0,2,0,0,0,0|1,0,0]=3 4981 B12R1.121 C=CCSc1[n]cccc1C#N Amb25221573 [0,2,0,0,0,0|2,0,0]=4 4982 B12R1.121 C=CCSc1c[n]ccc1C#N Amb25284788 [0,2,0,0,0,0|2,0,0]=4 4983 B12R1.121 C=CCSc1ccccc1C#N Amb24493469 [0,2,0,0,0,0|1,0,0]=3 4984 B12R1.121 C=C\C=C/c1ccccc1C=O Amb24101903 [0,2,0,0,0,0|1,0,1]=4 4985 B12R1.121 C=C\C=C\c1ccccc1C=O Amb18645056 [0,2,0,0,0,0|1,0,1]=4 4986 B12R1.121 CCCNc1ccccc1CCl Amb24630890 [0,2,0,0,0,0|0,0,2]=4 4987 B12R1.121 CCCNc1ccccc1CN Amb18800850 [0,2,0,0,0,0|0,0,2]=4 4988 B12R1.121 CCc1ccccc1NCC#C Amb18800157 [0,2,0,0,0,0|0,0,2]=4 4989 B12R1.121 CCc1ccccc1NCC=C Amb18792394 [0,2,0,0,0,0|0,0,0]=2 4990 B12R1.121 CCc1ccccc1NCC=O Amb25667250 [0,2,0,0,0,0|1,0,0]=3 4991 B12R1.121 CCc1ccccc1NCCN Amb24513622 [0,2,0,0,0,0|1,0,1]=4 4992 B12R1.121 CNc1ccccc1SCC=C Amb18316373 [0,2,0,0,0,0|1,0,0]=3 4993 B12R1.121 COc1[n]cc[n]c1NCC=C Amb24370566 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.121 COc1ccccc1NCC#C Amb18985949 [0,2,0,0,0,0|0,0,2]=4 4995 B12R1.121 COc1ccccc1NCCF Amb25855105 [0,2,0,0,0,0|1,0,1]=4 4996 B12R1.121 COc1ccccc1\C=C\C=C Amb24574093 [0,2,0,0,0,0|1,0,1]=4 4997 B12R1.121 CSc1ccccc1NCC#C Amb25724010 [0,2,0,0,0,0|0,0,2]=4 4998 B12R1.121 CSc1ccccc1NCC#N Amb25816577 [0,2,0,0,0,0|1,0,1]=4 4999 B12R1.121 CSc1ccccc1NCCF Amb24467958 [0,2,0,0,0,0|1,0,1]=4 5000 B12R1.121 ClCCNc1ccccc1C#N Amb17335460 [0,2,0,0,0,0|1,0,1]=4 5001 B12R1.121 ClCCNc1ccccc1CC Amb17335667 [0,2,0,0,0,0|1,0,1]=4 5002 B12R1.121 ClCCNc1ccccc1OC Amb17335806 [0,2,0,0,0,0|1,0,1]=4 5003 B12R1.121 N#CCNc1ccccc1CO Amb24415420 [0,2,0,0,0,0|1,0,1]=4 5004 B12R1.121 N#Cc1ccccc1CCC=O Amb25685434 [0,2,0,0,0,0|2,0,0]=4 5005 B12R1.121 N#Cc1ccccc1NCCF Amb25305472 [0,2,0,0,0,0|1,0,1]=4 5006 B12R1.121 N#Cc1ccccc1OCC=O Amb18800497 [0,2,0,0,0,0|2,0,0]=4 5007 B12R1.121 NCCNc1ccccc1C#N Amb17933166 [0,2,0,0,0,0|1,0,1]=4 5008 B12R1.121 NCCNc1ccccc1C#N Amb18289758 [0,2,0,0,0,0|1,0,1]=4 5009 B12R1.121 NCCNc1ccccc1OC Amb17057753 [0,2,0,0,0,0|1,0,1]=4 5010 B12R1.121 NCc1ccccc1NCCF Amb24594115 [0,2,0,0,0,0|1,0,1]=4 5011 B12R1.121 NNc1ncccc1OCC=C Amb17207294 [0,2,0,0,0,0|2,0,0]=4 5012 B12R1.121 O=CCCc1ccccc1CCl Amb24092985 [0,2,0,0,0,0|2,0,0]=4 5013 B12R1.121 O=CCCc1ccccc1OC Amb17081677 [0,2,0,0,0,0|2,0,0]=4 5014 B12R1.121 O=Cc1ccccc1NCCF Amb24708154 [0,2,0,0,0,0|1,0,1]=4 5015 B12R1.121 OCc1ccccc1NCCO Amb25042975 [0,2,0,0,0,0|1,0,1]=4 5016 B12R1.125 C=C(Br)CNc1[n]cc[n]c1Cl Amb25156859 [0,2,0,0,0,0|2,0,0]=4 5017 B12R1.125 C=C(Br)CNc1[n]cc[n]c1N Amb24713026 [0,2,0,0,0,0|2,0,0]=4 5018 B12R1.125 C=C(Br)CNc1[n]cccc1I Amb24393841 [0,2,0,0,0,0|1,0,0]=3 5019 B12R1.125 C=C(Br)CNc1cc[n]cc1Cl Amb25766794 [0,2,0,0,0,0|1,0,0]=3 5020 B12R1.125 C=C(Br)CNc1ccccc1Cl Amb25053602 [0,2,0,0,0,0|0,0,0]=2 5021 B12R1.125 C=C(Br)CNc1ccccc1F Amb25138559 [0,2,0,0,0,0|0,0,0]=2 5022 B12R1.125 C=C(Br)CNc1ccccc1N Amb25830760 [0,2,0,0,0,0|0,0,0]=2 5023 B12R1.125 C=C(Br)COc1cccc[n+]1[O-] Amb24429699 [0,2,0,0,0,0|2,0,0]=4 5024 B12R1.125 C=C(Br)COc1ccccc1F Amb24484229 [0,2,0,0,0,0|1,0,0]=3 5025 B12R1.125 C=C(Br)COc1ccccc1N Amb18971551 [0,2,0,0,0,0|1,0,0]=3 5026 B12R1.125 C=C(Br)COc1ccccc1O Amb25837219 [0,2,0,0,0,0|1,0,0]=3 5027 B12R1.125 C=C(Br)CSc1[n]cccc1Cl Amb25350126 [0,2,0,0,0,0|2,0,0]=4 5028 B12R1.125 C=C(Br)CSc1[n]cccc1N Amb18969575 [0,2,0,0,0,0|2,0,0]=4 5029 B12R1.125 C=C(Br)CSc1cc[n]cc1N Amb18969574 [0,2,0,0,0,0|2,0,0]=4 5030 B12R1.125 C=C(Br)CSc1cccc[n+]1[O-] Amb25761928 [0,2,0,0,0,0|2,0,0]=4 5031 B12R1.125 C=C(Br)CSc1ccccc1Br Amb24372620 [0,2,0,0,0,0|1,0,0]=3 5032 B12R1.125 C=C(Br)CSc1ccccc1F Amb24720587 [0,2,0,0,0,0|1,0,0]=3 5033 B12R1.125 C=C(Br)CSc1ccccc1N Amb18969571 [0,2,0,0,0,0|1,0,0]=3 5034 B12R1.125 C=C(Cl)CNc1[n]c[n]cc1Cl Amb25851843 [0,2,0,0,0,0|2,0,0]=4 5035 B12R1.125 C=C(Cl)CNc1[n]c[n]cc1I Amb25839648 [0,2,0,0,0,0|2,0,0]=4 5036 B12R1.125 C=C(Cl)CNc1[n]cccc1F Amb24738120 [0,2,0,0,0,0|1,0,0]=3 5037 B12R1.125 C=C(Cl)CNc1[n]cccc1I Amb24370597 [0,2,0,0,0,0|1,0,0]=3 5038 B12R1.125 C=C(Cl)CNc1c[n]ccc1N Amb25108350 [0,2,0,0,0,0|1,0,0]=3 5039 B12R1.125 C=C(Cl)CNc1cc[n]cc1Br Amb24424363 [0,2,0,0,0,0|1,0,0]=3 5040 B12R1.125 C=C(Cl)CNc1cc[n]cc1Cl Amb25264332 [0,2,0,0,0,0|1,0,0]=3 5041 B12R1.125 C=C(Cl)CNc1cc[n]cc1N Amb25360607 [0,2,0,0,0,0|1,0,0]=3 5042 B12R1.125 C=C(Cl)CNc1ccc[n]c1N Amb25346931 [0,2,0,0,0,0|1,0,0]=3 5043 B12R1.125 C=C(Cl)CNc1ccccc1Br Amb24692494 [0,2,0,0,0,0|0,0,0]=2 5044 B12R1.125 C=C(Cl)CNc1ccccc1F Amb18968750 [0,2,0,0,0,0|0,0,0]=2 5045 B12R1.125 C=C(Cl)CNc1ccccc1N Amb25100758 [0,2,0,0,0,0|0,0,0]=2 5046 B12R1.125 C=C(Cl)COc1ccc[n]c1Br Amb25112227 [0,2,0,0,0,0|2,0,0]=4 5047 B12R1.125 C=C(Cl)COc1ccc[n]c1Cl Amb25330273 [0,2,0,0,0,0|2,0,0]=4 5048 B12R1.125 C=C(Cl)COc1ccc[n]c1F Amb25113758 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.125 C=C(Cl)COc1ccccc1Cl Amb25724454 [0,2,0,0,0,0|1,0,0]=3 5050 B12R1.125 C=C(Cl)COc1ccccc1N Amb18290043 [0,2,0,0,0,0|1,0,0]=3 5051 B12R1.125 C=C(Cl)CSc1[n]cccc1Br Amb25358497 [0,2,0,0,0,0|2,0,0]=4 5052 B12R1.125 C=C(Cl)CSc1ccccc1Cl Amb24631781 [0,2,0,0,0,0|1,0,0]=3 5053 B12R1.125 C=C(Cl)CSc1ccccc1O Amb19039654 [0,2,0,0,0,0|1,0,0]=3 5054 B12R1.125 C=C(F)COc1ccccc1Br Amb23570547 [0,2,0,0,0,0|1,0,0]=3 5055 B12R1.125 CC(=C)C#Cc1ccccc1O Amb24690657 [0,2,0,0,0,0|1,0,1]=4 5056 B12R1.125 CC(=C)CCc1ccc[n]c1N Amb25148822 [0,2,0,0,0,0|2,0,0]=4 5057 B12R1.125 CC(=C)CNc1[n]cc[n]c1Cl Amb25685148 [0,2,0,0,0,0|2,0,0]=4 5058 B12R1.125 CC(=C)CNc1[n]cccc1F Amb25101027 [0,2,0,0,0,0|1,0,0]=3 5059 B12R1.125 CC(=C)CNc1cc[n]cc1N Amb25202493 [0,2,0,0,0,0|1,0,0]=3 5060 B12R1.125 CC(=C)CNc1ccccc1Br Amb17306219 [0,2,0,0,0,0|0,0,0]=2 5061 B12R1.125 CC(=C)CNc1ccccc1C Amb17306597 [0,2,0,0,0,0|0,0,0]=2 5062 B12R1.125 CC(=C)CNc1ccccc1Cl Amb18809688 [0,2,0,0,0,0|0,0,0]=2 5063 B12R1.125 CC(=C)CNc1ccccc1F Amb18800922 [0,2,0,0,0,0|0,0,0]=2 5064 B12R1.125 CC(=C)CNc1ccccc1N Amb24727221 [0,2,0,0,0,0|0,0,0]=2 5065 B12R1.125 CC(=C)COC1=CC=CNC1=O Amb18034656 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.125 CC(=C)COc1ccc[n]c1F Amb25064102 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.125 CC(=C)COc1cccc[n+]1[O-] Amb25796810 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.125 CC(=C)COc1ccccc1Cl Amb25831212 [0,2,0,0,0,0|1,0,0]=3 5069 B12R1.125 CC(=C)COc1ccccc1F Amb25069154 [0,2,0,0,0,0|1,0,0]=3 5070 B12R1.125 CC(=C)COc1ccccc1I Amb24730906 [0,2,0,0,0,0|1,0,0]=3 5071 B12R1.125 CC(=C)COc1ccccc1N Amb2081551 [0,2,0,0,0,0|1,0,0]=3 5072 B12R1.125 CC(=C)COc1cccnc1N Amb17206808 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.125 CC(=C)CSc1[n]cccc1Cl Amb25817225 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.125 CC(=C)CSc1ccccc1Br Amb25077720 [0,2,0,0,0,0|1,0,0]=3 5075 B12R1.125 CC(=C)CSc1ccccc1O Amb18791174 [0,2,0,0,0,0|1,0,0]=3 5076 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,2,0,0,0,0|1,0,1]=4 5077 B12R1.125 CC(=O)CNc1ccccc1Cl Amb24552973 [0,2,0,0,0,0|0,0,1]=3 5078 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,2,0,0,0,0|1,0,1]=4 5079 B12R1.125 CC(=O)COc1ccccc1Cl Amb19075143 [0,2,0,0,0,0|1,0,1]=4 5080 B12R1.125 CC(=O)COc1ccccc1I Amb25692816 [0,2,0,0,0,0|1,0,1]=4 5081 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,2,0,0,0,0|1,0,1]=4 5082 B12R1.125 CC(=O)COc1ccccc1O Amb18646466 [0,2,0,0,0,0|1,0,1]=4 5083 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [0,2,0,0,0,0|1,0,1]=4 5084 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [0,2,0,0,0,0|1,0,1]=4 5085 B12R1.125 CC(C)=NNc1ccccc1Br Amb25822833 [0,2,0,0,0,0|1,0,1]=4 5086 B12R1.125 CC(C)=NNc1ccccc1C Amb25285473 [0,2,0,0,0,0|1,0,1]=4 5087 B12R1.125 CC(C)=NNc1ccccc1F Amb25774807 [0,2,0,0,0,0|1,0,1]=4 5088 B12R1.125 CC(C)CNc1ccccc1O Amb25739989 [0,2,0,0,0,0|0,0,2]=4 5089 B12R1.125 CC(CNc1ccccc1Br)O Amb17142610 [0,2,0,0,0,0|0,0,2]=4 5090 B12R1.125 CC(CNc1ccccc1C)O Amb17138592 [0,2,0,0,0,0|0,0,2]=4 5091 B12R1.125 CC(CNc1ccccc1Cl)O Amb17139125 [0,2,0,0,0,0|0,0,2]=4 5092 B12R1.125 CC(CNc1ccccc1F)O Amb17138650 [0,2,0,0,0,0|0,0,2]=4 5093 B12R1.125 CC(O)CNc1ccccc1O Amb18646739 [0,2,0,0,0,0|0,0,2]=4 5094 B12R1.125 Cc1[n]cccc1OCC(C)=C Amb25106632 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.125 Cc1c[n]ccc1NCC(=C)Cl Amb25728552 [0,2,0,0,0,0|1,0,0]=3 5096 B12R1.125 Cc1c[n]ccc1SCC(=C)Cl Amb25718260 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.125 Cc1ccc[n]c1NCC(C)=C Amb25362388 [0,2,0,0,0,0|1,0,0]=3 5098 B12R1.125 Cc1ccc[n]c1NCC(N)=O Amb18987730 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.125 Cc1ccccc1CCC(N)=N Amb18065464 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.125 Cc1ccccc1NCC(=C)Br Amb25149783 [0,2,0,0,0,0|0,0,0]=2 5102 B12R1.125 Cc1ccccc1NCC(=C)Cl Amb18809686 [0,2,0,0,0,0|0,0,0]=2 5103 B12R1.125 Cc1ccccc1NCC(C)=O Amb25062983 [0,2,0,0,0,0|0,0,1]=3 5104 B12R1.125 Cc1ccccc1NCC(F)F Amb18793934 [0,2,0,0,0,0|1,0,1]=4 5105 B12R1.125 Cc1ccccc1NC[C@H](C)O Amb25096984 [0,2,0,0,0,0|0,0,2]=4 5106 B12R1.125 Cc1ccccc1NNC(N)=N Amb25320803 [0,2,0,0,0,0|2,0,0]=4 5107 B12R1.125 Cc1ccccc1OCC(=C)Br Amb24484140 [0,2,0,0,0,0|1,0,0]=3 5108 B12R1.125 Cc1ccccc1OCC(=C)Cl Amb25751372 [0,2,0,0,0,0|1,0,0]=3 5109 B12R1.125 Cc1ccccc1SCC(C)=O Amb18796318 [0,2,0,0,0,0|1,0,1]=4 5110 B12R1.125 Cc1ccccc1SCC(N)=N Amb18181218 [0,2,0,0,0,0|2,0,0]=4 5111 B12R1.125 ClC(=C)CSc1cccc[n+]1[O-] Amb11211101 [0,2,0,0,0,0|2,0,0]=4 5112 B12R1.125 ClC(=C)CSc1ncccc1Cl Amb11290221 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [0,2,0,0,0,0|2,0,0]=4 5114 B12R1.125 ClC(=O)COc1ccccc1Br Amb16230053 [0,2,0,0,0,0|2,0,0]=4 5115 B12R1.125 ClC(=O)COc1ccccc1C Amb10880009 [0,2,0,0,0,0|2,0,0]=4 5116 B12R1.125 ClC(=O)COc1ccccc1Cl Amb16230049 [0,2,0,0,0,0|2,0,0]=4 5117 B12R1.125 ClC(=O)COc1ccccc1F Amb10880012 [0,2,0,0,0,0|2,0,0]=4 5118 B12R1.125 ClC(=O)CSc1ccccc1C Amb17143248 [0,2,0,0,0,0|2,0,0]=4 5119 B12R1.125 ClC(=O)CSc1ccccc1Cl Amb17143819 [0,2,0,0,0,0|2,0,0]=4 5120 B12R1.125 Clc1ccccc1NN=C(Br)Br Amb24497595 [0,2,0,0,0,0|2,0,0]=4 5121 B12R1.125 FC(F)CNc1ccccc1Cl Amb18320405 [0,2,0,0,0,0|1,0,1]=4 5122 B12R1.125 FC(F)CNc1ccccc1I Amb24693475 [0,2,0,0,0,0|1,0,1]=4 5123 B12R1.125 Fc1ccccc1NCC(F)F Amb18795536 [0,2,0,0,0,0|1,0,1]=4 5124 B12R1.125 NC(=N)CCc1ccccc1Br Amb18070244 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.125 NC(=N)CCc1ccccc1Cl Amb10844871 [0,2,0,0,0,0|2,0,0]=4 5126 B12R1.125 NC(=N)CCc1ccccc1F Amb18563718 [0,2,0,0,0,0|2,0,0]=4 5127 B12R1.125 NC(=N)COc1ccccc1C Amb10610301 [0,2,0,0,0,0|2,0,0]=4 5128 B12R1.125 NC(=N)COc1ccccc1O Amb25326714 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,2,0,0,0,0|2,0,0]=4 5132 B12R1.125 NC(=O)CNc1[n]cccc1Br Amb18292757 [0,2,0,0,0,0|2,0,0]=4 5133 B12R1.125 NC(=O)CNc1[n]cccc1F Amb18300629 [0,2,0,0,0,0|2,0,0]=4 5134 B12R1.125 NC(=O)CNc1ccccc1I Amb142128 [0,2,0,0,0,0|1,0,0]=3 5135 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,2,0,0,0,0|2,0,0]=4 5137 B12R1.125 NC(=O)CSc1ccccc1Br Amb10189178 [0,2,0,0,0,0|2,0,0]=4 5138 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.125 NC(=O)NNc1ccccc1Br Amb24495868 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.125 NC(=S)CCc1ccccc1F Amb17234010 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.125 NC(=S)COc1ccccc1O Amb24663202 [0,2,0,0,0,0|2,0,0]=4 5143 B12R1.125 NC(=S)NNc1ccccc1Br Amb18071689 [0,2,0,0,0,0|2,0,0]=4 5144 B12R1.125 Nc1[n]cccc1NCC(N)=O Amb24563744 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.125 Nc1c[n]ccc1NCC(O)=O Amb18987716 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.125 Nc1cc[n]cc1NCC(N)=O Amb25735982 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.125 Nc1ccc[n]c1NCC(O)=O Amb18989766 [0,2,0,0,0,0|2,0,0]=4 5148 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,2,0,0,0,0|2,0,0]=4 5149 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [0,2,0,0,0,0|1,0,0]=3 5150 B12R1.125 Nc1ccccc1OCC(N)=S Amb25329428 [0,2,0,0,0,0|2,0,0]=4 5151 B12R1.125 Nc1ccccc1OCC([O-])=O Amb21972214 [0,2,0,0,0,0|2,0,0]=4 5152 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,2,0,0,0,0|2,0,0]=4 5153 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,2,0,0,0,0|2,0,0]=4 5154 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|2,0,0]=4 5155 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|2,0,0]=4 5156 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,2,0,0,0,0|2,0,0]=4 5157 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|2,0,0]=4 5158 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|2,0,0]=4 5159 B12R1.125 OC(=O)CNc1[n]cccc1Br Amb25295571 [0,2,0,0,0,0|2,0,0]=4 5160 B12R1.125 OC(=O)CNc1[n]cccc1F Amb25777049 [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.125 OC(=O)CNc1c[n]ccc1Cl Amb22495942 [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.125 OC(=O)CNc1cc[n]cc1Cl Amb25119621 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.125 OC(=O)CNc1ccc[n]c1F Amb24615818 [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [0,2,0,0,0,0|1,0,0]=3 5165 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [0,2,0,0,0,0|1,0,0]=3 5166 B12R1.125 OC(=O)CNc1ncccc1Cl Amb2372425 [0,2,0,0,0,0|2,0,0]=4 5167 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [0,2,0,0,0,0|2,0,0]=4 5168 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [0,2,0,0,0,0|2,0,0]=4 5169 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [0,2,0,0,0,0|2,0,0]=4 5172 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.125 Oc1ccc[n]c1NCC(O)=O Amb18114848 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.125 [O-]C(=O)COc1ccccc1O Amb10789357 [0,2,0,0,0,0|2,0,0]=4 5177 B12R1.125 [O-][n+]1ccccc1NCC(O)=O Amb24560168 [0,2,0,0,0,0|2,0,0]=4 5178 B12R1.267 C#CCCNc1ccccc1Cl Amb25118560 [0,2,0,0,0,0|0,0,2]=4 5179 B12R1.267 C#CCCNc1ccccc1F Amb25047099 [0,2,0,0,0,0|0,0,2]=4 5180 B12R1.267 C#CCNCc1ccccc1Cl Amb1925447 [0,2,0,0,0,0|0,0,2]=4 5181 B12R1.267 C#CCNCc1ccccc1F Amb21979501 [0,2,0,0,0,0|0,0,2]=4 5182 B12R1.267 C=CCCCc1ccccc1C Amb13890662 [0,2,0,0,0,0|1,0,0]=3 5183 B12R1.267 C=CCCNc1[n]c[n]cc1Cl Amb24748872 [0,2,0,0,0,0|2,0,0]=4 5184 B12R1.267 C=CCCNc1[n]c[n]cc1I Amb24398375 [0,2,0,0,0,0|2,0,0]=4 5185 B12R1.267 C=CCCNc1[n]c[n]cc1N Amb25858484 [0,2,0,0,0,0|2,0,0]=4 5186 B12R1.267 C=CCCNc1[n]cc[n]c1Cl Amb24710864 [0,2,0,0,0,0|2,0,0]=4 5187 B12R1.267 C=CCCNc1[n]cc[n]c1N Amb25771286 [0,2,0,0,0,0|2,0,0]=4 5188 B12R1.267 C=CCCNc1[n]cccc1F Amb25706464 [0,2,0,0,0,0|1,0,0]=3 5189 B12R1.267 C=CCCNc1c[n]ccc1N Amb25716175 [0,2,0,0,0,0|1,0,0]=3 5190 B12R1.267 C=CCCNc1cc[n]cc1Br Amb24365839 [0,2,0,0,0,0|1,0,0]=3 5191 B12R1.267 C=CCCNc1cc[n]cc1Cl Amb24595669 [0,2,0,0,0,0|1,0,0]=3 5192 B12R1.267 C=CCCNc1cc[n]cc1N Amb25224460 [0,2,0,0,0,0|1,0,0]=3 5193 B12R1.267 C=CCCNc1ccc[n]c1N Amb24409180 [0,2,0,0,0,0|1,0,0]=3 5194 B12R1.267 C=CCCNc1ccccc1Cl Amb25373616 [0,2,0,0,0,0|0,0,0]=2 5195 B12R1.267 C=CCCNc1ccccc1I Amb24364914 [0,2,0,0,0,0|0,0,0]=2 5196 B12R1.267 C=CCCOc1ccc[n]c1Br Amb20241441 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,2,0,0,0,0|1,0,0]=3 5198 B12R1.267 C=CCNCc1ccccc1Br Amb20673595 [0,2,0,0,0,0|0,0,0]=2 5199 B12R1.267 C=CCNCc1ccccc1F Amb10609764 [0,2,0,0,0,0|0,0,0]=2 5200 B12R1.267 C=CCNCc1ccccc1F Amb22279672 [0,2,0,0,0,0|0,0,0]=2 5201 B12R1.267 C=CCNCc1ccccc1O Amb19890804 [0,2,0,0,0,0|0,0,0]=2 5202 B12R1.267 C=CCOCc1ccccc1Br Amb22360706 [0,2,0,0,0,0|1,0,0]=3 5203 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,2,0,0,0,0|1,0,0]=3 5204 B12R1.267 C=CCOCc1ccccc1N Amb22503744 [0,2,0,0,0,0|1,0,0]=3 5205 B12R1.267 C=CC\C=C\c1ccccc1N Amb18126195 [0,2,0,0,0,0|1,0,0]=3 5206 B12R1.267 C=CC\C=C\c1ccccc1O Amb25086592 [0,2,0,0,0,0|1,0,0]=3 5207 B12R1.267 C=C\C=C/Cc1ccccc1O Amb25834462 [0,2,0,0,0,0|1,0,1]=4 5208 B12R1.267 C=C\C=C\Cc1ccccc1N Amb18126196 [0,2,0,0,0,0|1,0,1]=4 5209 B12R1.267 C=C\C=C\Cc1ccccc1O Amb25179650 [0,2,0,0,0,0|1,0,1]=4 5210 B12R1.267 CC#CCNc1ccccc1Cl Amb18184671 [0,2,0,0,0,0|0,0,2]=4 5211 B12R1.267 CC#CCNc1ccccc1F Amb18182603 [0,2,0,0,0,0|0,0,2]=4 5212 B12R1.267 CC#CCNc1ccccc1N Amb25214877 [0,2,0,0,0,0|0,0,2]=4 5213 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,2,0,0,0,0|0,0,2]=4 5214 B12R1.267 CCCCNc1ccccc1S Amb25805362 [0,2,0,0,0,0|0,0,2]=4 5215 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,2,0,0,0,0|0,0,2]=4 5216 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,2,0,0,0,0|0,0,2]=4 5217 B12R1.267 CNCCNc1ccccc1Br Amb18312614 [0,2,0,0,0,0|0,0,2]=4 5218 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,2,0,0,0,0|0,0,2]=4 5219 B12R1.267 CNCCNc1ccccc1Cl Amb19025278 [0,2,0,0,0,0|0,0,2]=4 5220 B12R1.267 CNCCNc1ccccc1F Amb19025282 [0,2,0,0,0,0|0,0,2]=4 5221 B12R1.267 CSCCNc1ccccc1Cl Amb24451973 [0,2,0,0,0,0|0,0,2]=4 5222 B12R1.267 CSCCNc1ccccc1F Amb19025512 [0,2,0,0,0,0|0,0,2]=4 5223 B12R1.267 C\C=C/CNc1ccccc1F Amb24072922 [0,2,0,0,0,0|0,0,0]=2 5224 B12R1.267 C\C=C\C=C/c1ccccc1O Amb25059605 [0,2,0,0,0,0|1,0,1]=4 5225 B12R1.267 C\C=C\C=C\c1ccccc1O Amb25142713 [0,2,0,0,0,0|1,0,1]=4 5226 B12R1.267 C\C=C\CCc1ccccc1N Amb25233153 [0,2,0,0,0,0|1,0,0]=3 5227 B12R1.267 C\C=C\CCc1ccccc1O Amb24676835 [0,2,0,0,0,0|1,0,0]=3 5228 B12R1.267 C\C=C\CNC1=NC=CNC1=O Amb24551256 [0,2,0,0,0,0|2,0,0]=4 5229 B12R1.267 C\C=C\CNc1[n]c[n]cc1N Amb24536348 [0,2,0,0,0,0|2,0,0]=4 5230 B12R1.267 C\C=C\CNc1[n]cccc1N Amb24662128 [0,2,0,0,0,0|1,0,0]=3 5231 B12R1.267 C\C=C\CNc1cc[n]cc1Cl Amb24545381 [0,2,0,0,0,0|1,0,0]=3 5232 B12R1.267 C\C=C\CNc1ccccc1Br Amb25073121 [0,2,0,0,0,0|0,0,0]=2 5233 B12R1.267 C\C=C\CNc1ccccc1F Amb24365712 [0,2,0,0,0,0|0,0,0]=2 5234 B12R1.267 C\C=C\CNc1ccccc1I Amb24739328 [0,2,0,0,0,0|0,0,0]=2 5235 B12R1.267 C\C=C\CNc1ccccc1N Amb24588670 [0,2,0,0,0,0|0,0,0]=2 5236 B12R1.267 C\C=C\COc1cc[n]cc1Br Amb24413071 [0,2,0,0,0,0|2,0,0]=4 5237 B12R1.267 C\C=C\COc1cc[n]cc1I Amb24444269 [0,2,0,0,0,0|2,0,0]=4 5238 B12R1.267 C\C=C\COc1ccc[n]c1Cl Amb25765486 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.267 C\C=C\COc1ccc[n]c1N Amb25730031 [0,2,0,0,0,0|2,0,0]=4 5240 B12R1.267 C\C=C\COc1cccc[n+]1[O-] Amb25188129 [0,2,0,0,0,0|2,0,0]=4 5241 B12R1.267 C\C=C\COc1ccccc1F Amb24388004 [0,2,0,0,0,0|1,0,0]=3 5242 B12R1.267 C\C=C\COc1ccccc1I Amb25841807 [0,2,0,0,0,0|1,0,0]=3 5243 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,2,0,0,0,0|1,0,0]=3 5244 B12R1.267 C\C=C\CSc1ccccc1Cl Amb25345653 [0,2,0,0,0,0|1,0,0]=3 5245 B12R1.267 C\C=C\CSc1ccccc1F Amb25188271 [0,2,0,0,0,0|1,0,0]=3 5246 B12R1.267 C\C=C\CSc1ccccc1O Amb24422451 [0,2,0,0,0,0|1,0,0]=3 5247 B12R1.267 Cc1c[n]ccc1SC\C=C\C Amb24621533 [0,2,0,0,0,0|2,0,0]=4 5248 B12R1.267 Cc1c[n]ccc1SC\C=C\Cl Amb25205623 [0,2,0,0,0,0|2,0,0]=4 5249 B12R1.267 Cc1ccc[n]c1NCCC=C Amb25272494 [0,2,0,0,0,0|1,0,0]=3 5250 B12R1.267 Cc1ccc[n]c1SC\C=C\C Amb25058956 [0,2,0,0,0,0|2,0,0]=4 5251 B12R1.267 Cc1ccc[n]c1SC\C=C\Cl Amb25130949 [0,2,0,0,0,0|2,0,0]=4 5252 B12R1.267 Cc1ccccc1C#C\C=C/Cl Amb25111175 [0,2,0,0,0,0|1,0,1]=4 5253 B12R1.267 Cc1ccccc1CCC=CC Amb22347883 [0,2,0,0,0,0|1,0,0]=3 5254 B12R1.267 Cc1ccccc1CCNC=O Amb24637730 [0,2,0,0,0,0|2,0,0]=4 5255 B12R1.267 Cc1ccccc1CNCC#C Amb21979502 [0,2,0,0,0,0|0,0,2]=4 5256 B12R1.267 Cc1ccccc1C\C=C\C=O Amb24497170 [0,2,0,0,0,0|1,0,1]=4 5257 B12R1.267 Cc1ccccc1NCC#CC Amb18797550 [0,2,0,0,0,0|0,0,2]=4 5258 B12R1.267 Cc1ccccc1NCCC#C Amb24444032 [0,2,0,0,0,0|0,0,2]=4 5259 B12R1.267 Cc1ccccc1NCCC=C Amb25073730 [0,2,0,0,0,0|0,0,0]=2 5260 B12R1.267 Cc1ccccc1NCCN=C Amb24406582 [0,2,0,0,0,0|0,0,1]=3 5261 B12R1.267 Cc1ccccc1NCCNC Amb21959972 [0,2,0,0,0,0|0,0,2]=4 5262 B12R1.267 Cc1ccccc1NCCSC Amb19025516 [0,2,0,0,0,0|0,0,2]=4 5263 B12R1.267 Cc1ccccc1N\C=C\C=O Amb25102502 [0,2,0,0,0,0|0,0,1]=3 5264 B12R1.267 Cc1ccccc1N\N=C\C#N Amb25797029 [0,2,0,0,0,0|1,0,1]=4 5265 B12R1.267 Cl\C=C\COc1ccc[n]c1Br Amb25077046 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.267 Cl\C=C\COc1ccccc1I Amb24410456 [0,2,0,0,0,0|1,0,0]=3 5267 B12R1.267 Clc1ccc[n]c1SCC=CCl Amb20944741 [0,2,0,0,0,0|2,0,0]=4 5268 B12R1.267 Clc1ccc[n]c1SC\C=C\Cl Amb25669725 [0,2,0,0,0,0|2,0,0]=4 5269 B12R1.267 Clc1ccccc1SC\C=C\Cl Amb25797074 [0,2,0,0,0,0|1,0,0]=3 5270 B12R1.267 FCCCNc1ccccc1Cl Amb24426496 [0,2,0,0,0,0|0,0,2]=4 5271 B12R1.267 FCCCNc1ccccc1I Amb25847224 [0,2,0,0,0,0|0,0,2]=4 5272 B12R1.267 Fc1[n]cccc1OC\C=C\Cl Amb24377524 [0,2,0,0,0,0|2,0,0]=4 5273 B12R1.267 Fc1ccccc1NCCCF Amb24460043 [0,2,0,0,0,0|0,0,2]=4 5274 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,2,0,0,0,0|0,0,2]=4 5275 B12R1.267 N#CCNCc1ccccc1Br Amb18977750 [0,2,0,0,0,0|1,0,1]=4 5276 B12R1.267 N#CCNCc1ccccc1C Amb17400074 [0,2,0,0,0,0|1,0,1]=4 5277 B12R1.267 N#CCNCc1ccccc1O Amb24433925 [0,2,0,0,0,0|1,0,1]=4 5278 B12R1.267 N#C\C=N\Nc1ccccc1Br Amb25145156 [0,2,0,0,0,0|1,0,1]=4 5279 B12R1.267 N#C\C=N\Nc1ccccc1Cl Amb24497922 [0,2,0,0,0,0|1,0,1]=4 5280 B12R1.267 N#C\C=N\Nc1ccccc1F Amb25084069 [0,2,0,0,0,0|1,0,1]=4 5281 B12R1.267 NCCCNc1ccccc1C Amb17057721 [0,2,0,0,0,0|0,0,2]=4 5282 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,2,0,0,0,0|0,0,2]=4 5283 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,2,0,0,0,0|0,0,2]=4 5284 B12R1.267 NCCCNc1ccccc1O Amb25214340 [0,2,0,0,0,0|0,0,2]=4 5285 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,2,0,0,0,0|1,0,1]=4 5286 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,2,0,0,0,0|1,0,1]=4 5287 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,2,0,0,0,0|1,0,1]=4 5288 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,2,0,0,0,0|1,0,1]=4 5289 B12R1.267 Nc1ccccc1NCCCN Amb24367240 [0,2,0,0,0,0|0,0,2]=4 5290 B12R1.267 Nc1ccccc1OC\C=C\Br Amb24749836 [0,2,0,0,0,0|1,0,0]=3 5291 B12R1.267 Nc1ccccc1OC\C=C\Cl Amb18971536 [0,2,0,0,0,0|1,0,0]=3 5292 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|1,0,1]=4 5293 B12R1.267 O=CNCCc1ccccc1Cl Amb25101673 [0,2,0,0,0,0|2,0,0]=4 5294 B12R1.267 O=CNCCc1ccccc1F Amb24399686 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.267 O=C\C=C\Nc1ccccc1Cl Amb24666760 [0,2,0,0,0,0|0,0,1]=3 5296 B12R1.267 O=C\C=N\Nc1ccccc1F Amb24424846 [0,2,0,0,0,0|1,0,0]=3 5297 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|0,0,2]=4 5298 B12R1.267 OCCCNc1ccccc1C Amb17306598 [0,2,0,0,0,0|0,0,2]=4 5299 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|0,0,2]=4 5300 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|0,0,2]=4 5301 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|1,0,1]=4 5302 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|1,0,1]=4 5303 B12R1.267 Oc1ccccc1C\C=C\C=O Amb25075559 [0,2,0,0,0,0|1,0,1]=4 5304 B12R1.371 C=CC(=O)Cc1ccccc1Cl Amb24350181 [0,2,0,0,0,0|1,0,1]=4 5305 B12R1.371 C=CC(=O)Nc1[n]cccc1Cl Amb25062354 [0,2,0,0,0,0|1,0,1]=4 5306 B12R1.371 C=CC(=O)Nc1ccccc1O Amb18645794 [0,2,0,0,0,0|0,0,1]=3 5307 B12R1.371 C=CC(=O)Oc1ccccc1Br Amb25156556 [0,2,0,0,0,0|1,0,1]=4 5308 B12R1.371 C=CC(Cl)Cc1ccccc1Cl Amb25123891 [0,2,0,0,0,0|1,0,0]=3 5309 B12R1.371 C=CC(N)Cc1ccccc1F Amb24471242 [0,2,0,0,0,0|1,0,0]=3 5310 B12R1.371 C=CC(O)Cc1ccccc1Br Amb24523932 [0,2,0,0,0,0|1,0,0]=3 5311 B12R1.371 CC(C#C)Nc1ccccc1Br Amb24709830 [0,2,0,0,0,0|0,0,2]=4 5312 B12R1.371 CC(C#C)Nc1ccccc1F Amb25690167 [0,2,0,0,0,0|0,0,2]=4 5313 B12R1.371 CC(C#C)Nc1ccccc1N Amb25779959 [0,2,0,0,0,0|0,0,2]=4 5314 B12R1.371 CC(C=C)NC1=NC=CNC1=O Amb25771531 [0,2,0,0,0,0|2,0,0]=4 5315 B12R1.371 CC(C=C)Nc1[n]c[n]cc1Br Amb24373703 [0,2,0,0,0,0|2,0,0]=4 5316 B12R1.371 CC(C=C)Nc1[n]c[n]cc1N Amb25720455 [0,2,0,0,0,0|2,0,0]=4 5317 B12R1.371 CC(C=C)Nc1[n]cc[n]c1Cl Amb25156898 [0,2,0,0,0,0|2,0,0]=4 5318 B12R1.371 CC(C=C)Nc1[n]cc[n]c1N Amb24712948 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.371 CC(C=C)Nc1[n]cccc1Br Amb25054274 [0,2,0,0,0,0|1,0,0]=3 5320 B12R1.371 CC(C=C)Nc1[n]cccc1N Amb25303361 [0,2,0,0,0,0|1,0,0]=3 5321 B12R1.371 CC(C=C)Nc1c[n]ccc1N Amb24554254 [0,2,0,0,0,0|1,0,0]=3 5322 B12R1.371 CC(C=C)Nc1cc[n]cc1Cl Amb25088184 [0,2,0,0,0,0|1,0,0]=3 5323 B12R1.371 CC(C=C)Nc1cc[n]cc1N Amb24368072 [0,2,0,0,0,0|1,0,0]=3 5324 B12R1.371 CC(C=C)Nc1ccccc1Br Amb24657117 [0,2,0,0,0,0|0,0,0]=2 5325 B12R1.371 CC(C=C)Nc1ccccc1Cl Amb25702696 [0,2,0,0,0,0|0,0,0]=2 5326 B12R1.371 CC(C=C)Nc1ccccc1F Amb25219959 [0,2,0,0,0,0|0,0,0]=2 5327 B12R1.371 CC(C=C)Nc1ccccc1I Amb25088843 [0,2,0,0,0,0|0,0,0]=2 5328 B12R1.371 CC(C=C)Nc1ccccc1N Amb24524947 [0,2,0,0,0,0|0,0,0]=2 5329 B12R1.371 CC(C=C)Oc1ccc[n]c1Cl Amb24485403 [0,2,0,0,0,0|2,0,0]=4 5330 B12R1.371 CC(C=C)Oc1ccccc1N Amb24100513 [0,2,0,0,0,0|1,0,0]=3 5331 B12R1.371 CC(C=C)Oc1ccccc1O Amb18798280 [0,2,0,0,0,0|1,0,0]=3 5332 B12R1.371 CC(C=C)Sc1[n]cccc1Cl Amb24412549 [0,2,0,0,0,0|2,0,0]=4 5333 B12R1.371 CC(C=C)Sc1[n]cccc1N Amb18990257 [0,2,0,0,0,0|2,0,0]=4 5334 B12R1.371 CC(C=C)Sc1cc[n]cc1N Amb18990256 [0,2,0,0,0,0|2,0,0]=4 5335 B12R1.371 CC(C=C)Sc1ccccc1Cl Amb24490566 [0,2,0,0,0,0|1,0,0]=3 5336 B12R1.371 CC(C=C)Sc1ccccc1F Amb25681159 [0,2,0,0,0,0|1,0,0]=3 5337 B12R1.371 CC(C=C)Sc1ccccc1N Amb18296542 [0,2,0,0,0,0|1,0,0]=3 5338 B12R1.371 CC(C=C)Sc1ccccc1O Amb18805139 [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.371 CC(C=O)Oc1ccccc1Cl Amb25224007 [0,2,0,0,0,0|2,0,0]=4 5340 B12R1.371 CC(CN)Nc1ccccc1Cl Amb18909432 [0,2,0,0,0,0|1,0,1]=4 5341 B12R1.371 CC(CN)Nc1ccccc1F Amb18908737 [0,2,0,0,0,0|1,0,1]=4 5342 B12R1.371 CC(CN)Nc1ccccc1I Amb24551694 [0,2,0,0,0,0|1,0,1]=4 5343 B12R1.371 CC(CO)Nc1ccccc1Br Amb18290138 [0,2,0,0,0,0|1,0,1]=4 5344 B12R1.371 CC(CO)Nc1ccccc1Cl Amb18971813 [0,2,0,0,0,0|1,0,1]=4 5345 B12R1.371 CC(CO)Nc1ccccc1F Amb18971852 [0,2,0,0,0,0|1,0,1]=4 5346 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [0,2,0,0,0,0|2,0,0]=4 5349 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.371 Cc1[n]cc[n]c1NC(C)C=C Amb25075007 [0,2,0,0,0,0|2,0,0]=4 5351 B12R1.371 Cc1c[n]ccc1NC(C)C=C Amb24442653 [0,2,0,0,0,0|1,0,0]=3 5352 B12R1.371 Cc1cc[n]cc1NC(=O)C=C Amb25707179 [0,2,0,0,0,0|1,0,1]=4 5353 B12R1.371 Cc1ccccc1CC(=O)C=C Amb25678802 [0,2,0,0,0,0|1,0,1]=4 5354 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [0,2,0,0,0,0|2,0,0]=4 5356 B12R1.371 Cc1ccccc1NC(C)C#C Amb25187507 [0,2,0,0,0,0|0,0,2]=4 5357 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,2,0,0,0,0|1,0,1]=4 5358 B12R1.371 Cc1ccccc1NC(C)CO Amb18971809 [0,2,0,0,0,0|1,0,1]=4 5359 B12R1.371 Cc1ccccc1NC(S)NN Amb25187674 [0,2,0,0,0,0|2,0,0]=4 5360 B12R1.371 Cc1ccccc1SC(C)C=C Amb25098335 [0,2,0,0,0,0|1,0,0]=3 5361 B12R1.371 N#CC(Nc1ccccc1Br)C Amb17406668 [0,2,0,0,0,0|1,0,1]=4 5362 B12R1.371 N#CC(Nc1ccccc1C)C Amb17400076 [0,2,0,0,0,0|1,0,1]=4 5363 B12R1.371 N#CC(Nc1ccccc1Cl)C Amb17400851 [0,2,0,0,0,0|1,0,1]=4 5364 B12R1.371 N#CC(Nc1ccccc1F)C Amb17400147 [0,2,0,0,0,0|1,0,1]=4 5365 B12R1.371 NNC(S)Nc1ccccc1Cl Amb24497118 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [0,2,0,0,0,0|2,0,0]=4 5369 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [0,2,0,0,0,0|2,0,0]=4 5370 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [0,2,0,0,0,0|2,0,0]=4 5371 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [0,2,0,0,0,0|2,0,0]=4 5372 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.374 C#CCNc1cc(Br)ccc1I Amb24493455 [0,2,0,0,0,0|0,0,2]=4 5376 B12R1.374 C#CCNc1cc(Cl)ccc1Br Amb24475431 [0,2,0,0,0,0|0,0,2]=4 5377 B12R1.374 C#CCNc1cc(Cl)ccc1F Amb19057368 [0,2,0,0,0,0|0,0,2]=4 5378 B12R1.374 C#CCNc1cc(F)ccc1Br Amb25822654 [0,2,0,0,0,0|0,0,2]=4 5379 B12R1.374 C=CCCc1cc(Br)ccc1F Amb25804334 [0,2,0,0,0,0|1,0,0]=3 5380 B12R1.374 C=CCCc1cc(Cl)c[n]c1N Amb25034655 [0,2,0,0,0,0|2,0,0]=4 5381 B12R1.374 C=CCNc1[n]c(Cl)[n]cc1Br Amb24455112 [0,2,0,0,0,0|2,0,0]=4 5382 B12R1.374 C=CCNc1cc(Br)ccc1F Amb24692416 [0,2,0,0,0,0|0,0,0]=2 5383 B12R1.374 C=CCNc1cc(Cl)ccc1F Amb19058327 [0,2,0,0,0,0|0,0,0]=2 5384 B12R1.374 C=CCNc1cc(F)ccc1Br Amb25375536 [0,2,0,0,0,0|0,0,0]=2 5385 B12R1.374 C=CCNc1cc(F)ccc1F Amb18295659 [0,2,0,0,0,0|0,0,0]=2 5386 B12R1.374 C=CCNc1cc(F)ccc1N Amb18992179 [0,2,0,0,0,0|0,0,0]=2 5387 B12R1.374 C=CCNc1cc(N)[n]cc1Br Amb25240698 [0,2,0,0,0,0|1,0,0]=3 5388 B12R1.374 C=CCOC1=CC(=O)C=CC1=O Amb25373844 [0,2,0,0,0,0|1,0,0]=3 5389 B12R1.374 C=CCOc1cc(Br)ccc1Cl Amb25282047 [0,2,0,0,0,0|1,0,0]=3 5390 B12R1.374 C=CCOc1cc(Cl)ccc1F Amb24343683 [0,2,0,0,0,0|1,0,0]=3 5391 B12R1.374 C=CCOc1cc(Cl)ccc1N Amb18991663 [0,2,0,0,0,0|1,0,0]=3 5392 B12R1.374 C=CCOc1cc(F)ccc1Br Amb24605603 [0,2,0,0,0,0|1,0,0]=3 5393 B12R1.374 C=CCOc1cc(F)ccc1Cl Amb25377701 [0,2,0,0,0,0|1,0,0]=3 5394 B12R1.374 C=CCOc1cc(F)ccc1N Amb18298740 [0,2,0,0,0,0|1,0,0]=3 5395 B12R1.374 C=CCOc1cc(N)[n]cc1Br Amb24636087 [0,2,0,0,0,0|2,0,0]=4 5396 B12R1.374 C=CCOc1cc(N)ccc1Br Amb24525540 [0,2,0,0,0,0|1,0,0]=3 5397 B12R1.374 C=CCOc1cc(N)ccc1Cl Amb23454613 [0,2,0,0,0,0|1,0,0]=3 5398 B12R1.374 C=CCOc1cc(O)ccc1Cl Amb18649015 [0,2,0,0,0,0|1,0,0]=3 5399 B12R1.374 C=CCOc1cc(O)ccc1F Amb24537787 [0,2,0,0,0,0|1,0,0]=3 5400 B12R1.374 C=CCSc1cc(Cl)ccc1Cl Amb24688252 [0,2,0,0,0,0|1,0,0]=3 5401 B12R1.374 C=CCSc1cc(F)ccc1F Amb24440101 [0,2,0,0,0,0|1,0,0]=3 5402 B12R1.374 C=CCSc1cc(N)[n]cc1Br Amb25232222 [0,2,0,0,0,0|2,0,0]=4 5403 B12R1.374 C=CCSc1cc(O)ccc1O Amb24532560 [0,2,0,0,0,0|1,0,0]=3 5404 B12R1.374 C=COCc1cc(F)ccc1F Amb25751889 [0,2,0,0,0,0|2,0,0]=4 5405 B12R1.374 CCCNc1cc(Br)ccc1I Amb25670015 [0,2,0,0,0,0|0,0,2]=4 5406 B12R1.374 CCCNc1cc(Br)ccc1N Amb25738246 [0,2,0,0,0,0|0,0,2]=4 5407 B12R1.374 CCCNc1cc(Cl)ccc1Br Amb25675324 [0,2,0,0,0,0|0,0,2]=4 5408 B12R1.374 CCCNc1cc(F)ccc1N Amb18989853 [0,2,0,0,0,0|0,0,2]=4 5409 B12R1.374 COCNc1cc(Cl)ccc1Cl Amb25289200 [0,2,0,0,0,0|1,0,1]=4 5410 B12R1.374 Cc1[n]cc(Br)c(NCC=C)[n]1 Amb24417360 [0,2,0,0,0,0|2,0,0]=4 5411 B12R1.374 Cc1c[n]c(Cl)[n]c1NCC=C Amb18220471 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.374 Cc1c[n]c(Cl)cc1SCC=C Amb24394680 [0,2,0,0,0,0|2,0,0]=4 5413 B12R1.374 Cc1cc(CCC=O)c(C)cc1 Amb18798123 [0,2,0,0,0,0|2,0,0]=4 5414 B12R1.374 Cc1cc(CCC=O)c(F)cc1 Amb25775656 [0,2,0,0,0,0|2,0,0]=4 5415 B12R1.374 Cc1cc(CCC=O)c(O)cc1 Amb24527959 [0,2,0,0,0,0|2,0,0]=4 5416 B12R1.374 Cc1cc(NCC#C)c(C)cc1 Amb18800150 [0,2,0,0,0,0|0,0,2]=4 5417 B12R1.374 Cc1cc(NCC#C)c(F)cc1 Amb18792476 [0,2,0,0,0,0|0,0,2]=4 5418 B12R1.374 Cc1cc(NCC=C)c(C)cc1 Amb18792396 [0,2,0,0,0,0|0,0,0]=2 5419 B12R1.374 Cc1cc(NCC=C)c(F)cc1 Amb18792657 [0,2,0,0,0,0|0,0,0]=2 5420 B12R1.374 Cc1cc(NCCF)c(Br)cc1 Amb24736608 [0,2,0,0,0,0|1,0,1]=4 5421 B12R1.374 Cc1cc(NCCF)c(C)cc1 Amb24667607 [0,2,0,0,0,0|1,0,1]=4 5422 B12R1.374 Cc1cc(NCCN)c(Br)cc1 Amb25281394 [0,2,0,0,0,0|1,0,1]=4 5423 B12R1.374 Cc1cc(NCCN)c(F)cc1 Amb18299160 [0,2,0,0,0,0|1,0,1]=4 5424 B12R1.374 Cc1cc(NCCO)c(Cl)cc1 Amb24420961 [0,2,0,0,0,0|1,0,1]=4 5425 B12R1.374 Cc1cc(OCC=C)c(F)cc1 Amb24572950 [0,2,0,0,0,0|1,0,0]=3 5426 B12R1.374 Cc1cc(OCC=C)c(I)cc1 Amb25318288 [0,2,0,0,0,0|1,0,0]=3 5427 B12R1.374 Cc1cc(OCC=C)c(cc1)N Amb17138557 [0,2,0,0,0,0|1,0,0]=3 5428 B12R1.374 Cc1cc(OCC=O)c(Cl)cc1 Amb19075149 [0,2,0,0,0,0|2,0,0]=4 5429 B12R1.374 Cc1ccc(Br)c(c1)NCCC Amb25797222 [0,2,0,0,0,0|0,0,2]=4 5430 B12R1.374 Cc1ccc(Br)cc1OCC=C Amb24116404 [0,2,0,0,0,0|1,0,0]=3 5431 B12R1.374 Cc1ccc(Cl)cc1CCC=O Amb18564227 [0,2,0,0,0,0|2,0,0]=4 5432 B12R1.374 Cc1ccc(Cl)cc1NCC#C Amb18809275 [0,2,0,0,0,0|0,0,2]=4 5433 B12R1.374 Cc1ccc(Cl)cc1NCC=C Amb18796544 [0,2,0,0,0,0|0,0,0]=2 5434 B12R1.374 Cc1ccc(Cl)cc1NCCF Amb25702797 [0,2,0,0,0,0|1,0,1]=4 5435 B12R1.374 Cc1ccc(Cl)cc1OCC=C Amb25742598 [0,2,0,0,0,0|1,0,0]=3 5436 B12R1.374 Cc1ccc(Cl)cc1OCC=O Amb25139225 [0,2,0,0,0,0|2,0,0]=4 5437 B12R1.374 Cc1ccc(F)c(c1)NCCF Amb24739348 [0,2,0,0,0,0|1,0,1]=4 5438 B12R1.374 Cc1ccc(F)cc1CCC=C Amb25259828 [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.374 Cc1ccc(F)cc1NCC#C Amb18800698 [0,2,0,0,0,0|0,0,2]=4 5440 B12R1.374 Cc1ccc(F)cc1NCC=C Amb18792653 [0,2,0,0,0,0|0,0,0]=2 5441 B12R1.374 Cc1ccc(F)cc1NCCN Amb18992218 [0,2,0,0,0,0|1,0,1]=4 5442 B12R1.374 Cc1ccc(F)cc1OCC=C Amb24352587 [0,2,0,0,0,0|1,0,0]=3 5443 B12R1.374 Cc1ccc(I)cc1NCC#C Amb24440520 [0,2,0,0,0,0|0,0,2]=4 5444 B12R1.374 Cc1ccc(I)cc1NCC#N Amb25310900 [0,2,0,0,0,0|1,0,1]=4 5445 B12R1.374 Cc1ccc(I)cc1NCCF Amb24739352 [0,2,0,0,0,0|1,0,1]=4 5446 B12R1.374 Cc1ccc(I)cc1NCCN Amb25359504 [0,2,0,0,0,0|1,0,1]=4 5447 B12R1.374 Cc1ccc(I)cc1NCCO Amb24390698 [0,2,0,0,0,0|1,0,1]=4 5448 B12R1.374 Cc1ccc(N)c([n]1)SCC=C Amb25736918 [0,2,0,0,0,0|2,0,0]=4 5449 B12R1.374 Cc1ccc(N)c(c1)NCCC Amb23114177 [0,2,0,0,0,0|0,0,2]=4 5450 B12R1.374 Cc1ccc(N)cc1NCC=C Amb18993397 [0,2,0,0,0,0|0,0,0]=2 5451 B12R1.374 Cc1ccc(N)cc1NCCC Amb18299607 [0,2,0,0,0,0|0,0,2]=4 5452 B12R1.374 Cc1ccc(N)cc1NCCN Amb18299627 [0,2,0,0,0,0|1,0,1]=4 5453 B12R1.374 Cc1ccc(N)cc1NCCO Amb18993356 [0,2,0,0,0,0|1,0,1]=4 5454 B12R1.374 Cc1ccc(O)cc1CCC=O Amb24093052 [0,2,0,0,0,0|2,0,0]=4 5455 B12R1.374 Cc1ccc(O)cc1NCCC Amb24405966 [0,2,0,0,0,0|0,0,2]=4 5456 B12R1.374 Cc1ccc(c(n1)NCC=C)N Amb17209147 [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.374 Cc1ccc(cc1NCCCl)C Amb17335662 [0,2,0,0,0,0|1,0,1]=4 5458 B12R1.374 Cc1ccc(cc1NCCN)C Amb17091051 [0,2,0,0,0,0|1,0,1]=4 5459 B12R1.374 Cc1ccc(cc1NCCN)Cl Amb17091058 [0,2,0,0,0,0|1,0,1]=4 5460 B12R1.374 Cc1ccc(cc1OCC=C)N Amb17138558 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.374 Cc1ccc(cc1SCC=O)C Amb17082911 [0,2,0,0,0,0|2,0,0]=4 5462 B12R1.374 ClCCNc1cc(Cl)ccc1C Amb17338052 [0,2,0,0,0,0|1,0,1]=4 5463 B12R1.374 ClCCNc1cc(Cl)ccc1Cl Amb17343164 [0,2,0,0,0,0|1,0,1]=4 5464 B12R1.374 Clc1ccc(cc1CCC=O)Cl Amb10606178 [0,2,0,0,0,0|2,0,0]=4 5465 B12R1.374 Clc1ccc(cc1NCC=C)Cl Amb17306516 [0,2,0,0,0,0|0,0,0]=2 5466 B12R1.374 FCCNc1cc(Br)ccc1Br Amb25690163 [0,2,0,0,0,0|1,0,1]=4 5467 B12R1.374 FCCNc1cc(Cl)ccc1Cl Amb25776303 [0,2,0,0,0,0|1,0,1]=4 5468 B12R1.374 FCCNc1cc(F)ccc1F Amb25067555 [0,2,0,0,0,0|1,0,1]=4 5469 B12R1.374 Fc1ccc(Br)cc1NCCF Amb24488700 [0,2,0,0,0,0|1,0,1]=4 5470 B12R1.374 Fc1ccc(Cl)c(c1)NCCF Amb25817155 [0,2,0,0,0,0|1,0,1]=4 5471 B12R1.374 Fc1ccc(cc1NCC#C)F Amb17307292 [0,2,0,0,0,0|0,0,2]=4 5472 B12R1.374 Fc1cnc(nc1NCC=C)Cl Amb1149324 [0,2,0,0,0,0|2,0,0]=4 5473 B12R1.374 N#CCNc1cc(Br)ccc1Cl Amb18287826 [0,2,0,0,0,0|1,0,1]=4 5474 B12R1.374 N#CCNc1cc(Br)ccc1I Amb25710113 [0,2,0,0,0,0|1,0,1]=4 5475 B12R1.374 N#CCNc1cc(I)ccc1Br Amb25765614 [0,2,0,0,0,0|1,0,1]=4 5476 B12R1.374 N#CCNc1cc(I)ccc1Cl Amb25708282 [0,2,0,0,0,0|1,0,1]=4 5477 B12R1.374 NCCNc1cc(Br)ccc1Br Amb25302841 [0,2,0,0,0,0|1,0,1]=4 5478 B12R1.374 NCCNc1cc(Br)ccc1F Amb24732633 [0,2,0,0,0,0|1,0,1]=4 5479 B12R1.374 NCCNc1cc(Br)ccc1I Amb25086988 [0,2,0,0,0,0|1,0,1]=4 5480 B12R1.374 NCCNc1cc(Cl)ccc1Br Amb25268806 [0,2,0,0,0,0|1,0,1]=4 5481 B12R1.374 NCCNc1cc(Cl)ccc1Cl Amb17091082 [0,2,0,0,0,0|1,0,1]=4 5482 B12R1.374 NCCNc1cc(Cl)ccc1F Amb18243910 [0,2,0,0,0,0|1,0,1]=4 5483 B12R1.374 NCCNc1cc(F)ccc1Cl Amb24380239 [0,2,0,0,0,0|1,0,1]=4 5484 B12R1.374 NCCNc1cc(F)ccc1F Amb18997936 [0,2,0,0,0,0|1,0,1]=4 5485 B12R1.374 Nc1cc(CCC=O)c(Cl)cc1 Amb25352154 [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.374 Nc1cc(CCC=O)c(I)cc1 Amb24695620 [0,2,0,0,0,0|2,0,0]=4 5487 B12R1.374 Nc1ccc(Br)cc1CCC=O Amb24596596 [0,2,0,0,0,0|2,0,0]=4 5488 B12R1.374 Nc1ccc(Cl)cc1CCC=O Amb24756893 [0,2,0,0,0,0|2,0,0]=4 5489 B12R1.374 Nc1ccc(Cl)cc1NCCF Amb25137457 [0,2,0,0,0,0|1,0,1]=4 5490 B12R1.374 Nc1ccc(Cl)cc1NCCN Amb25843427 [0,2,0,0,0,0|1,0,1]=4 5491 B12R1.374 Nc1ccc(Cl)cc1NCCO Amb18649473 [0,2,0,0,0,0|1,0,1]=4 5492 B12R1.374 Nc1ccc(F)cc1NCCN Amb18991517 [0,2,0,0,0,0|1,0,1]=4 5493 B12R1.374 Nc1ccc(F)cc1NCCO Amb18989891 [0,2,0,0,0,0|1,0,1]=4 5494 B12R1.374 O=CCCc1cc(Br)ccc1Cl Amb24093048 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.374 O=CCCc1cc(Cl)ccc1Br Amb25669683 [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.374 O=CCCc1cc(Cl)ccc1F Amb25336451 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.374 O=CCCc1cc(F)ccc1Br Amb20669022 [0,2,0,0,0,0|2,0,0]=4 5498 B12R1.374 O=CCCc1cc(F)ccc1F Amb18801724 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.374 O=CCCc1cc(F)ccc1I Amb25302517 [0,2,0,0,0,0|2,0,0]=4 5500 B12R1.374 O=CCOc1cc(Br)ccc1F Amb24361042 [0,2,0,0,0,0|2,0,0]=4 5501 B12R1.374 O=CCSc1cc(Cl)ccc1Cl Amb25751305 [0,2,0,0,0,0|2,0,0]=4 5502 B12R1.374 O=CCSc1cc(F)ccc1F Amb19077118 [0,2,0,0,0,0|2,0,0]=4 5503 B12R1.374 OCCNc1cc(Br)ccc1Br Amb25149787 [0,2,0,0,0,0|1,0,1]=4 5504 B12R1.374 OCCNc1cc(Br)ccc1I Amb24386418 [0,2,0,0,0,0|1,0,1]=4 5505 B12R1.374 OCCNc1cc(Cl)ccc1Br Amb25284978 [0,2,0,0,0,0|1,0,1]=4 5506 B12R1.374 OCCNc1cc(F)ccc1Cl Amb24559136 [0,2,0,0,0,0|1,0,1]=4 5507 B12R1.374 OCCNc1cc(I)ccc1Br Amb25765613 [0,2,0,0,0,0|1,0,1]=4 5508 B12R1.374 Oc1cc(CCC=O)c(Br)cc1 Amb25311997 [0,2,0,0,0,0|2,0,0]=4 5509 B12R1.374 Oc1cc(CCC=O)c(S)cc1 Amb25253244 [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.374 Oc1ccc(F)cc1CCC=O Amb24432683 [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.1631 C#CCNc1c(Cl)cccc1Cl Amb25040213 [0,2,0,0,0,0|0,0,2]=4 5512 B12R1.1631 C#CCNc1c(F)cccc1Br Amb25375350 [0,2,0,0,0,0|0,0,2]=4 5513 B12R1.1631 C#CCNc1c(F)cccc1Cl Amb25789853 [0,2,0,0,0,0|0,0,2]=4 5514 B12R1.1631 C#CCNc1c(F)cccc1F Amb17307362 [0,2,0,0,0,0|0,0,2]=4 5515 B12R1.1631 C=CCCN1C(=O)C=CC=C1Cl Amb24497998 [0,2,0,0,0,0|2,0,0]=4 5516 B12R1.1631 C=CCCc1c(Br)c[n]cc1Br Amb24638981 [0,2,0,0,0,0|2,0,0]=4 5517 B12R1.1631 C=CCNc1c(Br)cccc1Br Amb25818397 [0,2,0,0,0,0|0,0,0]=2 5518 B12R1.1631 C=CCNc1c(C)cccc1C Amb17306408 [0,2,0,0,0,0|0,0,0]=2 5519 B12R1.1631 C=CCNc1c(Cl)[n]c[n]c1Cl Amb21959552 [0,2,0,0,0,0|2,0,0]=4 5520 B12R1.1631 C=CCNc1c(Cl)cccc1Cl Amb17306282 [0,2,0,0,0,0|0,0,0]=2 5521 B12R1.1631 C=CCNc1c(F)cccc1Cl Amb24657874 [0,2,0,0,0,0|0,0,0]=2 5522 B12R1.1631 C=CCNc1c(F)cccc1F Amb18295623 [0,2,0,0,0,0|0,0,0]=2 5523 B12R1.1631 C=CCNc1c(N)cccc1Cl Amb18299109 [0,2,0,0,0,0|0,0,0]=2 5524 B12R1.1631 C=CCNc1c(N)cccc1F Amb25857730 [0,2,0,0,0,0|0,0,0]=2 5525 B12R1.1631 C=CCOc1c(Cl)cccc1Cl Amb25075776 [0,2,0,0,0,0|1,0,0]=3 5526 B12R1.1631 C=CCOc1c(F)cccc1Br Amb22896475 [0,2,0,0,0,0|1,0,0]=3 5527 B12R1.1631 C=CCOc1c(F)cccc1Cl Amb24525648 [0,2,0,0,0,0|1,0,0]=3 5528 B12R1.1631 C=CCOc1c(F)cccc1F Amb22641482 [0,2,0,0,0,0|1,0,0]=3 5529 B12R1.1631 C=CCOc1c(N)cccc1Cl Amb25052568 [0,2,0,0,0,0|1,0,0]=3 5530 B12R1.1631 C=CCOc1c(O)ccnc1C Amb17219243 [0,2,0,0,0,0|2,0,0]=4 5531 B12R1.1631 C=CCSc1c(N)c[n]cc1Br Amb25081794 [0,2,0,0,0,0|2,0,0]=4 5532 B12R1.1631 C=CCSc1c(N)c[n]cc1Cl Amb24421992 [0,2,0,0,0,0|2,0,0]=4 5533 B12R1.1631 CC=1OC=CC(=O)C1OCC=C Amb18035382 [0,2,0,0,0,0|2,0,0]=4 5534 B12R1.1631 CCCNc1c(Cl)cccc1Cl Amb17306283 [0,2,0,0,0,0|0,0,2]=4 5535 B12R1.1631 CCCNc1c(N)cccc1F Amb22289420 [0,2,0,0,0,0|0,0,2]=4 5536 B12R1.1631 Cc1cc[n]c(Cl)c1OCC=C Amb25160493 [0,2,0,0,0,0|2,0,0]=4 5537 B12R1.1631 Cc1cc[n]c(N)c1CCC=C Amb25857252 [0,2,0,0,0,0|2,0,0]=4 5538 B12R1.1631 Cc1cccc(Br)c1CCC=O Amb24341814 [0,2,0,0,0,0|2,0,0]=4 5539 B12R1.1631 Cc1cccc(Br)c1OCC=C Amb25084424 [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.1631 Cc1cccc(C)c1CCC=O Amb24092993 [0,2,0,0,0,0|2,0,0]=4 5541 B12R1.1631 Cc1cccc(C)c1NCC#C Amb18797551 [0,2,0,0,0,0|0,0,2]=4 5542 B12R1.1631 Cc1cccc(C)c1NCCF Amb24418635 [0,2,0,0,0,0|1,0,1]=4 5543 B12R1.1631 Cc1cccc(C)c1SCC=C Amb25800888 [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.1631 Cc1cccc(Cl)c1NCC#N Amb25667554 [0,2,0,0,0,0|1,0,1]=4 5545 B12R1.1631 Cc1cccc(Cl)c1NCCO Amb25148802 [0,2,0,0,0,0|1,0,1]=4 5546 B12R1.1631 Cc1cccc(F)c1CCC=O Amb24432818 [0,2,0,0,0,0|2,0,0]=4 5547 B12R1.1631 Cc1cccc(F)c1NCCF Amb25111768 [0,2,0,0,0,0|1,0,1]=4 5548 B12R1.1631 Cc1cccc(N)c1NCCC Amb24678901 [0,2,0,0,0,0|0,0,2]=4 5549 B12R1.1631 Cc1cccc(N)c1SCC=C Amb24435294 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.1631 ClCCNc1c(C)cccc1C Amb17335665 [0,2,0,0,0,0|1,0,1]=4 5551 B12R1.1631 FCCNc1c(Cl)cccc1Cl Amb25707140 [0,2,0,0,0,0|1,0,1]=4 5552 B12R1.1631 Fc1cccc(Cl)c1NCCF Amb25113742 [0,2,0,0,0,0|1,0,1]=4 5553 B12R1.1631 N#CCNc1c(Br)cccc1Br Amb24441821 [0,2,0,0,0,0|1,0,1]=4 5554 B12R1.1631 N#CCNc1c(C)cccc1C Amb17400079 [0,2,0,0,0,0|1,0,1]=4 5555 B12R1.1631 N#CCNc1c(F)cccc1Cl Amb25228963 [0,2,0,0,0,0|1,0,1]=4 5556 B12R1.1631 NCCNc1c(Br)cccc1Br Amb25823941 [0,2,0,0,0,0|1,0,1]=4 5557 B12R1.1631 NCCNc1c(C)cccc1C Amb17091053 [0,2,0,0,0,0|1,0,1]=4 5558 B12R1.1631 NCCNc1c(Cl)cccc1Cl Amb18130950 [0,2,0,0,0,0|1,0,1]=4 5559 B12R1.1631 NCCNc1c(F)cccc1Br Amb24669803 [0,2,0,0,0,0|1,0,1]=4 5560 B12R1.1631 NCCNc1c(F)cccc1F Amb17091087 [0,2,0,0,0,0|1,0,1]=4 5561 B12R1.1631 Nc1cccc(Br)c1CCC=O Amb25217703 [0,2,0,0,0,0|2,0,0]=4 5562 B12R1.1631 Nc1cccc(Cl)c1CCC=O Amb24727767 [0,2,0,0,0,0|2,0,0]=4 5563 B12R1.1631 Nc1cccc(Cl)c1NCCF Amb25094961 [0,2,0,0,0,0|1,0,1]=4 5564 B12R1.1631 Nc1cccc(Cl)c1NCCN Amb18991499 [0,2,0,0,0,0|1,0,1]=4 5565 B12R1.1631 Nc1cccc(F)c1CCC=O Amb24579332 [0,2,0,0,0,0|2,0,0]=4 5566 B12R1.1631 Nc1cccc(F)c1NCCN Amb25089972 [0,2,0,0,0,0|1,0,1]=4 5567 B12R1.1631 Nc1cccc(N)c1CCC=O Amb25195431 [0,2,0,0,0,0|2,0,0]=4 5568 B12R1.1631 Nc1cccc(N)c1NCCO Amb25758923 [0,2,0,0,0,0|1,0,1]=4 5569 B12R1.1631 Nc1cccc(O)c1CCC=O Amb24756892 [0,2,0,0,0,0|2,0,0]=4 5570 B12R1.1631 O=CCCc1c(Br)cccc1Br Amb24092995 [0,2,0,0,0,0|2,0,0]=4 5571 B12R1.1631 O=CCCc1c(Cl)cccc1Cl Amb24092996 [0,2,0,0,0,0|2,0,0]=4 5572 B12R1.1631 O=CCCc1c(F)cccc1Br Amb25035166 [0,2,0,0,0,0|2,0,0]=4 5573 B12R1.1631 O=CCCc1c(F)cccc1Cl Amb17081684 [0,2,0,0,0,0|2,0,0]=4 5574 B12R1.1631 O=CCCc1c(F)cccc1F Amb25728226 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.1631 O=CCCc1c(F)cccc1I Amb25055675 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.1631 O=CCOc1c(Br)cccc1Br Amb25282461 [0,2,0,0,0,0|2,0,0]=4 5577 B12R1.1631 OCCNc1c(Br)cccc1Br Amb24375032 [0,2,0,0,0,0|1,0,1]=4 5578 B12R1.1631 OCCNc1c(C)cccc1C Amb17306428 [0,2,0,0,0,0|1,0,1]=4 5579 B12R1.1631 OCCNc1c(Cl)cccc1Cl Amb17306298 [0,2,0,0,0,0|1,0,1]=4 5580 B12R1.1631 OCCNc1c(F)cccc1Br Amb24375111 [0,2,0,0,0,0|1,0,1]=4 5581 B12R1.1631 Oc1cccc(F)c1CCC=O Amb25066926 [0,2,0,0,0,0|2,0,0]=4 5582 B12R1.1631 Oc1cccc(I)c1CCC=O Amb25784762 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.1631 Oc1cccc(O)c1CCC=O Amb25268615 [0,2,0,0,0,0|2,0,0]=4 5584 B12R1.28 C#CCCNc1cccc(F)c1 Amb25800317 [0,2,0,0,0,0|0,0,2]=4 5585 B12R1.28 C#CCNCc1cccc(Br)c1 Amb21979461 [0,2,0,0,0,0|0,0,2]=4 5586 B12R1.28 C#CCNCc1cccc(Cl)c1 Amb21979462 [0,2,0,0,0,0|0,0,2]=4 5587 B12R1.28 C=CCCCc1cccc(c1)C Amb13890666 [0,2,0,0,0,0|1,0,0]=3 5588 B12R1.28 C=CCCCc1cccc(c1)Cl Amb13890654 [0,2,0,0,0,0|1,0,0]=3 5589 B12R1.28 C=CCCCc1cccc(c1)F Amb13890678 [0,2,0,0,0,0|1,0,0]=3 5590 B12R1.28 C=CCCNc1[n]c(N)cc[n]1 Amb25706063 [0,2,0,0,0,0|2,0,0]=4 5591 B12R1.28 C=CCCNc1c[n]cc(Cl)[n]1 Amb25156823 [0,2,0,0,0,0|2,0,0]=4 5592 B12R1.28 C=CCCNc1cc(Cl)[n]c[n]1 Amb25321774 [0,2,0,0,0,0|2,0,0]=4 5593 B12R1.28 C=CCCNc1cc[n]c(Cl)[n]1 Amb24693512 [0,2,0,0,0,0|2,0,0]=4 5594 B12R1.28 C=CCCNc1cc[n]c(Cl)c1 Amb25156824 [0,2,0,0,0,0|1,0,0]=3 5595 B12R1.28 C=CCCNc1cc[n]c(N)[n]1 Amb25816501 [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.28 C=CCCNc1cc[n]c(N)c1 Amb24341806 [0,2,0,0,0,0|1,0,0]=3 5597 B12R1.28 C=CCCNc1cccc(Br)[n]1 Amb24650644 [0,2,0,0,0,0|1,0,0]=3 5598 B12R1.28 C=CCCNc1cccc(F)c1 Amb24072145 [0,2,0,0,0,0|0,0,0]=2 5599 B12R1.28 C=CCCOc1cc(Br)cc[n]1 Amb24065855 [0,2,0,0,0,0|2,0,0]=4 5600 B12R1.28 C=CCCOc1cccc(I)c1 Amb22503741 [0,2,0,0,0,0|1,0,0]=3 5601 B12R1.28 C=CCCOc1cccc(N)c1 Amb24271220 [0,2,0,0,0,0|1,0,0]=3 5602 B12R1.28 C=CCNCc1cccc(Cl)c1 Amb19890325 [0,2,0,0,0,0|0,0,0]=2 5603 B12R1.28 C=CCNCc1cccc(F)c1 Amb20673583 [0,2,0,0,0,0|0,0,0]=2 5604 B12R1.28 C=CCNCc1cccc(O)c1 Amb19890781 [0,2,0,0,0,0|0,0,0]=2 5605 B12R1.28 C=CCNCc1cccc(c1)Br Amb1923351 [0,2,0,0,0,0|0,0,0]=2 5606 B12R1.28 C=CCOCc1c[n]cc(Br)c1 Amb24097386 [0,2,0,0,0,0|2,0,0]=4 5607 B12R1.28 C=CCOCc1cccc(I)c1 Amb22503743 [0,2,0,0,0,0|1,0,0]=3 5608 B12R1.28 CC#CCNc1cc(Br)ccc1 Amb25790724 [0,2,0,0,0,0|0,0,2]=4 5609 B12R1.28 CC#CCNc1cc(Cl)ccc1 Amb18804981 [0,2,0,0,0,0|0,0,2]=4 5610 B12R1.28 CC#CCNc1cc(F)ccc1 Amb18798188 [0,2,0,0,0,0|0,0,2]=4 5611 B12R1.28 CC#CCNc1cc(I)ccc1 Amb25268833 [0,2,0,0,0,0|0,0,2]=4 5612 B12R1.28 CCCCNc1cccc(I)c1 Amb19232035 [0,2,0,0,0,0|0,0,2]=4 5613 B12R1.28 CCCNCc1cccc(F)c1 Amb20673497 [0,2,0,0,0,0|0,0,2]=4 5614 B12R1.28 CCCNCc1cccc(O)c1 Amb20673478 [0,2,0,0,0,0|0,0,2]=4 5615 B12R1.28 CCCNCc1cccc(c1)Br Amb1922696 [0,2,0,0,0,0|0,0,2]=4 5616 B12R1.28 CCCNCc1cccc(c1)Cl Amb1923473 [0,2,0,0,0,0|0,0,2]=4 5617 B12R1.28 CNCCNc1cc(Br)ccc1 Amb19025286 [0,2,0,0,0,0|0,0,2]=4 5618 B12R1.28 CNCCNc1cc(Cl)ccc1 Amb19025283 [0,2,0,0,0,0|0,0,2]=4 5619 B12R1.28 CNCCNc1cc(F)ccc1 Amb19025285 [0,2,0,0,0,0|0,0,2]=4 5620 B12R1.28 CSCCNc1cccc(F)c1 Amb19025515 [0,2,0,0,0,0|0,0,2]=4 5621 B12R1.28 CSCCNc1cccc(I)c1 Amb25232446 [0,2,0,0,0,0|0,0,2]=4 5622 B12R1.28 CSCCNc1cccc(c1)C Amb17307508 [0,2,0,0,0,0|0,0,2]=4 5623 B12R1.28 C\C=C\C=Cc1cccc(O)c1 Amb24707058 [0,2,0,0,0,0|1,0,1]=4 5624 B12R1.28 C\C=C\CNC1=CC(=O)NC=N1 Amb25298211 [0,2,0,0,0,0|2,0,0]=4 5625 B12R1.28 C\C=C\CNc1cc(Br)[n]c[n]1 Amb25231804 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.28 C\C=C\CNc1cc(F)[n]c[n]1 Amb25374182 [0,2,0,0,0,0|2,0,0]=4 5627 B12R1.28 C\C=C\CNc1cc(N)cc[n]1 Amb24647430 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.28 C\C=C\CNc1cc[n]c(N)[n]1 Amb24608409 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.28 C\C=C\CNc1cccc(Br)[n]1 Amb24606955 [0,2,0,0,0,0|1,0,0]=3 5630 B12R1.28 C\C=C\CNc1cccc(I)c1 Amb25232855 [0,2,0,0,0,0|0,0,0]=2 5631 B12R1.28 C\C=C\CNc1cccc(N)[n]1 Amb24557201 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.28 C\C=C\COc1c[n]cc(Br)c1 Amb24370822 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.28 C\C=C\COc1c[n]cc(N)c1 Amb25139849 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.28 C\C=C\COc1cc[n]c(F)c1 Amb25328199 [0,2,0,0,0,0|2,0,0]=4 5635 B12R1.28 C\C=C\COc1cccc(Br)[n]1 Amb25078688 [0,2,0,0,0,0|2,0,0]=4 5636 B12R1.28 C\C=C\COc1cccc(Cl)[n]1 Amb25729814 [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.28 C\C=C\COc1cccc(N)c1 Amb18971501 [0,2,0,0,0,0|1,0,0]=3 5638 B12R1.28 Cc1[n]c(cc[n]1)NCCC=C Amb25323092 [0,2,0,0,0,0|2,0,0]=4 5639 B12R1.28 Cc1cc(CCNC=O)ccc1 Amb25758483 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.28 Cc1cc(CNCC#C)ccc1 Amb21979538 [0,2,0,0,0,0|0,0,2]=4 5641 B12R1.28 Cc1cc(CNCC=C)ccc1 Amb19890661 [0,2,0,0,0,0|0,0,0]=2 5642 B12R1.28 Cc1cc(NCCC=C)[n]cc1 Amb24388836 [0,2,0,0,0,0|1,0,0]=3 5643 B12R1.28 Cc1cc(cc[n]1)NC\C=C\C Amb25279100 [0,2,0,0,0,0|1,0,0]=3 5644 B12R1.28 Cc1cc(ccc1)C#C\C=C/Cl Amb24425549 [0,2,0,0,0,0|1,0,1]=4 5645 B12R1.28 Cc1cc(ccc1)NCCCF Amb25809142 [0,2,0,0,0,0|0,0,2]=4 5646 B12R1.28 Cc1cc(ccc1)NC\C=C/Cl Amb25751198 [0,2,0,0,0,0|0,0,0]=2 5647 B12R1.28 Cc1cc[n]c(NC\C=C\C)[n]1 Amb24706552 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.28 Cc1cccc(CNCCC)c1 Amb20673492 [0,2,0,0,0,0|0,0,2]=4 5649 B12R1.28 Cc1cccc(NCCC=C)[n]1 Amb25349780 [0,2,0,0,0,0|1,0,0]=3 5650 B12R1.28 Cc1cccc(NC\C=C\C)[n]1 Amb24735900 [0,2,0,0,0,0|1,0,0]=3 5651 B12R1.28 Cc1cccc(N\C=C\C=O)[n]1 Amb25223181 [0,2,0,0,0,0|1,0,1]=4 5652 B12R1.28 Cc1cccc(c1)NCC#CC Amb18797549 [0,2,0,0,0,0|0,0,2]=4 5653 B12R1.28 Cc1cccc(c1)NCCNC Amb19025279 [0,2,0,0,0,0|0,0,2]=4 5654 B12R1.28 Cl\C=C\CNc1c[n]cc(Br)c1 Amb25039050 [0,2,0,0,0,0|1,0,0]=3 5655 B12R1.28 Cl\C=C\CNc1cccc(Br)c1 Amb25363084 [0,2,0,0,0,0|0,0,0]=2 5656 B12R1.28 Cl\C=C\COc1c[n]cc(Br)c1 Amb24487241 [0,2,0,0,0,0|2,0,0]=4 5657 B12R1.28 Cl\C=C\COc1cccc(I)c1 Amb24467213 [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.28 Cl\C=C\CSc1cccc(Br)c1 Amb24388230 [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.28 Clc1cccc(c1)OC\C=C\Cl Amb25125538 [0,2,0,0,0,0|1,0,0]=3 5660 B12R1.28 Clc1cccc(c1)SC\C=C\Cl Amb24721263 [0,2,0,0,0,0|1,0,0]=3 5661 B12R1.28 FCCCNc1cccc(Br)c1 Amb25679781 [0,2,0,0,0,0|0,0,2]=4 5662 B12R1.28 FCCCNc1cccc(Cl)c1 Amb24350967 [0,2,0,0,0,0|0,0,2]=4 5663 B12R1.28 Fc1cc(ccc1)NC\C=C\Cl Amb24709921 [0,2,0,0,0,0|0,0,0]=2 5664 B12R1.28 Fc1cccc(c1)NCCCF Amb24452997 [0,2,0,0,0,0|0,0,2]=4 5665 B12R1.28 N#CC=NNc1cccc(Cl)c1 Amb24068922 [0,2,0,0,0,0|1,0,1]=4 5666 B12R1.28 N#CCCNc1cccc(c1)C Amb1647378 [0,2,0,0,0,0|0,0,2]=4 5667 B12R1.28 N#CCCNc1cccc(c1)Cl Amb1647289 [0,2,0,0,0,0|0,0,2]=4 5668 B12R1.28 N#CCCNc1cccc(c1)O Amb17142902 [0,2,0,0,0,0|0,0,2]=4 5669 B12R1.28 N#CCNCc1cccc(Br)c1 Amb18977748 [0,2,0,0,0,0|1,0,1]=4 5670 B12R1.28 N#CCNCc1cccc(c1)C Amb17400075 [0,2,0,0,0,0|1,0,1]=4 5671 B12R1.28 N#CCNCc1cccc(c1)Cl Amb2416269 [0,2,0,0,0,0|1,0,1]=4 5672 B12R1.28 N#C\C=N\Nc1cccc(Br)c1 Amb25113734 [0,2,0,0,0,0|1,0,1]=4 5673 B12R1.28 NCCCNc1cccc(c1)C Amb17057722 [0,2,0,0,0,0|0,0,2]=4 5674 B12R1.28 NCCCNc1cccc(c1)Cl Amb17057728 [0,2,0,0,0,0|0,0,2]=4 5675 B12R1.28 NCCCNc1cccc(c1)F Amb17057725 [0,2,0,0,0,0|0,0,2]=4 5676 B12R1.28 NCCNCc1cccc(Br)c1 Amb19005476 [0,2,0,0,0,0|1,0,1]=4 5677 B12R1.28 NCCNCc1cccc(O)c1 Amb19005503 [0,2,0,0,0,0|1,0,1]=4 5678 B12R1.28 NCCNCc1cccc(c1)C Amb10075511 [0,2,0,0,0,0|1,0,1]=4 5679 B12R1.28 NCCNCc1cccc(c1)Cl Amb10075509 [0,2,0,0,0,0|1,0,1]=4 5680 B12R1.28 NCCNCc1cccc(c1)F Amb10075489 [0,2,0,0,0,0|1,0,1]=4 5681 B12R1.28 Nc1cc(ccc1)NCCCF Amb25132504 [0,2,0,0,0,0|0,0,2]=4 5682 B12R1.28 Nc1cc(ccc1)OC\C=C\Cl Amb18971499 [0,2,0,0,0,0|1,0,0]=3 5683 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|1,0,1]=4 5684 B12R1.28 O=CCCSc1cccc(c1)C Amb17082972 [0,2,0,0,0,0|1,0,1]=4 5685 B12R1.28 O=CCCSc1cccc(c1)Cl Amb17082982 [0,2,0,0,0,0|1,0,1]=4 5686 B12R1.28 O=CNCCc1cccc(Br)c1 Amb24694394 [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.28 O=CNCCc1cccc(F)c1 Amb25853482 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.28 O=C\C=C\Nc1cccc(Cl)c1 Amb25054021 [0,2,0,0,0,0|0,0,1]=3 5689 B12R1.28 OCCCNc1cccc(I)c1 Amb25091300 [0,2,0,0,0,0|0,0,2]=4 5690 B12R1.28 OCCCNc1cccc(c1)Br Amb17306225 [0,2,0,0,0,0|0,0,2]=4 5691 B12R1.28 OCCCNc1cccc(c1)C Amb17306565 [0,2,0,0,0,0|0,0,2]=4 5692 B12R1.28 OCCCNc1cccc(c1)Cl Amb17307144 [0,2,0,0,0,0|0,0,2]=4 5693 B12R1.28 OCCCNc1cccc(c1)F Amb17306246 [0,2,0,0,0,0|0,0,2]=4 5694 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|1,0,1]=4 5695 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|1,0,1]=4 5696 B12R1.28 Oc1cc(CCNC=O)ccc1 Amb24399967 [0,2,0,0,0,0|2,0,0]=4 5697 B12R1.50 C=CC(=O)Cc1cccc(Br)c1 Amb24450582 [0,2,0,0,0,0|1,0,1]=4 5698 B12R1.50 C=CC(=O)Cc1cccc(N)c1 Amb25809299 [0,2,0,0,0,0|1,0,1]=4 5699 B12R1.50 C=CC(=O)Nc1c[n]cc(F)c1 Amb25765615 [0,2,0,0,0,0|1,0,1]=4 5700 B12R1.50 C=CC(=O)Nc1cc[n]c(Br)c1 Amb25109704 [0,2,0,0,0,0|1,0,1]=4 5701 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [0,2,0,0,0,0|0,0,1]=3 5702 B12R1.50 C=CC(=O)Oc1cccc(F)c1 Amb25156555 [0,2,0,0,0,0|1,0,1]=4 5703 B12R1.50 C=CC(N)Cc1cccc(Cl)c1 Amb25126466 [0,2,0,0,0,0|1,0,0]=3 5704 B12R1.50 C=CC(O)Cc1cccc(Cl)c1 Amb25343968 [0,2,0,0,0,0|1,0,0]=3 5705 B12R1.50 CC(C=C)Nc1c[n]cc(Br)c1 Amb25783577 [0,2,0,0,0,0|1,0,0]=3 5706 B12R1.50 CC(C=C)Nc1cc(Br)[n]c[n]1 Amb24368187 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.50 CC(C=C)Nc1cc(Cl)[n]c[n]1 Amb25702802 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.50 CC(C=C)Nc1cc(N)[n]c[n]1 Amb25771332 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.50 CC(C=C)Nc1cc[n]c(N)[n]1 Amb24406351 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.50 CC(C=C)Nc1cccc(Br)c1 Amb24591347 [0,2,0,0,0,0|0,0,0]=2 5711 B12R1.50 CC(C=C)Nc1cccc(Cl)[n]1 Amb24396310 [0,2,0,0,0,0|1,0,0]=3 5712 B12R1.50 CC(C=C)Oc1c[n]cc(Br)c1 Amb24457942 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.50 CC(C=C)Oc1cccc(Br)c1 Amb25212875 [0,2,0,0,0,0|1,0,0]=3 5714 B12R1.50 CC(C=C)Oc1cccc(N)c1 Amb18990275 [0,2,0,0,0,0|1,0,0]=3 5715 B12R1.50 CC(C=C)Oc1cccc(O)c1 Amb18798281 [0,2,0,0,0,0|1,0,0]=3 5716 B12R1.50 CC(C=C)Sc1cccc(O)c1 Amb25280610 [0,2,0,0,0,0|1,0,0]=3 5717 B12R1.50 CC(C=O)Oc1cccc(Cl)c1 Amb19045647 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.50 CC(CN)Nc1cccc(F)c1 Amb18908739 [0,2,0,0,0,0|1,0,1]=4 5719 B12R1.50 CC(CO)Nc1cccc(Br)c1 Amb18290175 [0,2,0,0,0,0|1,0,1]=4 5720 B12R1.50 CC(CO)Nc1cccc(Cl)c1 Amb18290158 [0,2,0,0,0,0|1,0,1]=4 5721 B12R1.50 CC(CO)Nc1cccc(F)c1 Amb18971844 [0,2,0,0,0,0|1,0,1]=4 5722 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.50 C[C@@H](CO)Nc1cccc(Cl)c1 Amb22831872 [0,2,0,0,0,0|1,0,1]=4 5726 B12R1.50 Cc1[n]c(cc[n]1)NC(C)C=C Amb24712022 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.50 Cc1c[n]cc(NC(C)C=C)[n]1 Amb24705513 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.50 Cc1cc(CC(=O)C=C)ccc1 Amb25278058 [0,2,0,0,0,0|1,0,1]=4 5729 B12R1.50 Cc1cc(CC(O)C=C)ccc1 Amb24431083 [0,2,0,0,0,0|1,0,0]=3 5730 B12R1.50 Cc1cc(C[C@@H](O)C=C)ccc1 Amb25155807 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.50 Cc1cc(NC(C)C=C)[n]c[n]1 Amb24740633 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.50 Cc1cc(c[n]c1)NC(=O)C=C Amb25847264 [0,2,0,0,0,0|1,0,1]=4 5733 B12R1.50 Cc1cc(cc[n]1)NC(C)C=C Amb25793365 [0,2,0,0,0,0|1,0,0]=3 5734 B12R1.50 Cc1cc(ccc1)NC(=O)C=O Amb24468252 [0,2,0,0,0,0|1,0,1]=4 5735 B12R1.50 Cc1cc(ccc1)NC(S)NN Amb24746678 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.50 Cc1cc(ccc1)OC(=O)C=C Amb25330984 [0,2,0,0,0,0|1,0,1]=4 5737 B12R1.50 Cc1cc[n]c(NC(C)C=C)[n]1 Amb25291283 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.50 Cc1cccc(NC(C)C=C)[n]1 Amb24738119 [0,2,0,0,0,0|1,0,0]=3 5740 B12R1.50 Cc1cccc(c1)NC(C)CN Amb18251702 [0,2,0,0,0,0|1,0,1]=4 5741 B12R1.50 Cc1cccc(c1)NC(C)CO Amb18971818 [0,2,0,0,0,0|1,0,1]=4 5742 B12R1.50 Cc1cccc(c1)OC(C)C=C Amb24484277 [0,2,0,0,0,0|1,0,0]=3 5743 B12R1.50 Cc1cccc(c1)OC(C)C=O Amb25780101 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.50 Cc1cccc(c1)SC(C)C=C Amb25153316 [0,2,0,0,0,0|1,0,0]=3 5745 B12R1.50 N#CC(Nc1cccc(c1)Br)C Amb17406669 [0,2,0,0,0,0|1,0,1]=4 5746 B12R1.50 N#CC(Nc1cccc(c1)C)C Amb17400077 [0,2,0,0,0,0|1,0,1]=4 5747 B12R1.50 N#CC(Nc1cccc(c1)Cl)C Amb17400852 [0,2,0,0,0,0|1,0,1]=4 5748 B12R1.50 N#CC(Nc1cccc(c1)F)C Amb17400149 [0,2,0,0,0,0|1,0,1]=4 5749 B12R1.50 NCC(Nc1cccc(c1)Cl)C Amb17226673 [0,2,0,0,0,0|1,0,1]=4 5750 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [0,2,0,0,0,0|2,0,0]=4 5755 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.100 C#CCNc1cc(Cl)cc(Cl)c1 Amb18332621 [0,2,0,0,0,0|0,0,2]=4 5760 B12R1.100 C#CCNc1cc(F)cc(Cl)c1 Amb24472576 [0,2,0,0,0,0|0,0,2]=4 5761 B12R1.100 C#CCNc1cc(F)cc(F)c1 Amb18798744 [0,2,0,0,0,0|0,0,2]=4 5762 B12R1.100 C=CCCc1cc(C)nc(c1)C Amb10573775 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.100 C=CCCc1cc(F)cc(Cl)c1 Amb24615616 [0,2,0,0,0,0|1,0,0]=3 5764 B12R1.100 C=CCNC1=CC(=O)NC(=O)N1 Amb24739763 [0,2,0,0,0,0|2,0,0]=4 5765 B12R1.100 C=CCNC1=CC(=O)NC(N)=N1 Amb25321988 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.100 C=CCNc1[n]c(Br)cc(N)[n]1 Amb24733432 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.100 C=CCNc1[n]c(Cl)cc(Cl)[n]1 Amb24074228 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.100 C=CCNc1[n]c(F)cc(F)[n]1 Amb24485584 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.100 C=CCNc1cc(C)cc(c1)C Amb17306768 [0,2,0,0,0,0|0,0,0]=2 5770 B12R1.100 C=CCNc1cc(Cl)[n]c(Cl)[n]1 Amb24074227 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.100 C=CCNc1cc(Cl)cc(Br)c1 Amb25114865 [0,2,0,0,0,0|0,0,0]=2 5772 B12R1.100 C=CCNc1cc(Cl)cc(c1)Cl Amb17306158 [0,2,0,0,0,0|0,0,0]=2 5773 B12R1.100 C=CCNc1cc(F)cc(F)c1 Amb18295662 [0,2,0,0,0,0|0,0,0]=2 5774 B12R1.100 C=CCNc1cc(N)cc(F)c1 Amb18992178 [0,2,0,0,0,0|0,0,0]=2 5775 B12R1.100 C=CCOc1cc(Br)[n]c(Br)c1 Amb25377244 [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.100 C=CCOc1cc(Cl)cc(Cl)c1 Amb25762862 [0,2,0,0,0,0|1,0,0]=3 5777 B12R1.100 C=CCOc1cc(F)cc(F)c1 Amb25279969 [0,2,0,0,0,0|1,0,0]=3 5778 B12R1.100 C=CCOc1cc(F)cc(I)c1 Amb24645081 [0,2,0,0,0,0|1,0,0]=3 5779 B12R1.100 C=CCSC1=CC(N)=CC(=O)N1 Amb20660624 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.100 C=CCSc1cc(F)cc(F)c1 Amb25088279 [0,2,0,0,0,0|1,0,0]=3 5781 B12R1.100 C=CCSc1cc(N)cc(Cl)[n]1 Amb25069276 [0,2,0,0,0,0|2,0,0]=4 5782 B12R1.100 CCCNc1cc(F)cc(N)c1 Amb18289354 [0,2,0,0,0,0|0,0,2]=4 5783 B12R1.100 Cc1[n]c(Cl)cc(NCC=C)[n]1 Amb24684261 [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.100 Cc1[n]c(cc(C)[n]1)NCC=C Amb18986095 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.100 Cc1cc(Br)cc(c1)NCCN Amb25068548 [0,2,0,0,0,0|1,0,1]=4 5786 B12R1.100 Cc1cc(Br)cc(c1)NCCO Amb24653429 [0,2,0,0,0,0|1,0,1]=4 5787 B12R1.100 Cc1cc(CCC=C)[n]c(N)c1 Amb24696605 [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.100 Cc1cc(CCC=O)cc(Br)c1 Amb25141592 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.100 Cc1cc(CCC=O)cc(C)c1 Amb18798122 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.100 Cc1cc(CCC=O)cc(F)c1 Amb25839793 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.100 Cc1cc(F)cc(c1)NCCN Amb25034985 [0,2,0,0,0,0|1,0,1]=4 5792 B12R1.100 Cc1cc(I)cc(c1)NCCO Amb25160175 [0,2,0,0,0,0|1,0,1]=4 5793 B12R1.100 Cc1cc(N)cc(c1)NCCN Amb25098174 [0,2,0,0,0,0|1,0,1]=4 5794 B12R1.100 Cc1cc(NCC=C)[n]c(Cl)[n]1 Amb24368229 [0,2,0,0,0,0|2,0,0]=4 5795 B12R1.100 Cc1cc(NCC=C)[n]c(N)[n]1 Amb24561553 [0,2,0,0,0,0|2,0,0]=4 5796 B12R1.100 Cc1cc(cc(Br)c1)NCC#N Amb24443678 [0,2,0,0,0,0|1,0,1]=4 5797 B12R1.100 Cc1cc(cc(Br)c1)NCC=C Amb24535442 [0,2,0,0,0,0|0,0,0]=2 5798 B12R1.100 Cc1cc(cc(C)[n]1)NCC=C Amb25067569 [0,2,0,0,0,0|1,0,0]=3 5799 B12R1.100 Cc1cc(cc(C)c1)NCC#C Amb18800154 [0,2,0,0,0,0|0,0,2]=4 5800 B12R1.100 Cc1cc(cc(C)c1)OCC=C Amb25667217 [0,2,0,0,0,0|1,0,0]=3 5801 B12R1.100 Cc1cc(cc(Cl)c1)OCC=C Amb25790276 [0,2,0,0,0,0|1,0,0]=3 5802 B12R1.100 Cc1cc(cc(I)c1)NCC=C Amb24569778 [0,2,0,0,0,0|0,0,0]=2 5803 B12R1.100 Cc1cc(cc(N)c1)NCCO Amb24431310 [0,2,0,0,0,0|1,0,1]=4 5804 B12R1.100 Cc1cc(cc(N)c1)SCC=C Amb25067274 [0,2,0,0,0,0|1,0,0]=3 5805 B12R1.100 Cc1cc(cc(O)c1)OCC=C Amb24408439 [0,2,0,0,0,0|1,0,0]=3 5806 B12R1.100 ClCCNc1cc(C)cc(c1)C Amb17335664 [0,2,0,0,0,0|1,0,1]=4 5807 B12R1.100 ClCCNc1cc(Cl)cc(c1)Cl Amb17343165 [0,2,0,0,0,0|1,0,1]=4 5808 B12R1.100 Fc1cc(Cl)cc(c1)NCCF Amb25720516 [0,2,0,0,0,0|1,0,1]=4 5809 B12R1.100 N#CCNc1cc(F)cc(Cl)c1 Amb25817324 [0,2,0,0,0,0|1,0,1]=4 5810 B12R1.100 NCCNc1cc(Br)cc(Cl)c1 Amb24502463 [0,2,0,0,0,0|1,0,1]=4 5811 B12R1.100 NCCNc1cc(C)cc(c1)C Amb17057763 [0,2,0,0,0,0|1,0,1]=4 5812 B12R1.100 NCCNc1cc(Cl)cc(F)c1 Amb25817322 [0,2,0,0,0,0|1,0,1]=4 5813 B12R1.100 NCCNc1cc(Cl)cc(c1)Cl Amb17091083 [0,2,0,0,0,0|1,0,1]=4 5814 B12R1.100 NCCNc1cc(F)cc(F)c1 Amb18299159 [0,2,0,0,0,0|1,0,1]=4 5815 B12R1.100 Nc1cc(CCC=O)cc(O)c1 Amb24566643 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.100 Nc1cc(F)cc(c1)NCCN Amb18991515 [0,2,0,0,0,0|1,0,1]=4 5817 B12R1.100 Nc1cc(F)cc(c1)NCCO Amb18969362 [0,2,0,0,0,0|1,0,1]=4 5818 B12R1.100 O=CCCc1cc(Cl)cc(Cl)c1 Amb18066575 [0,2,0,0,0,0|2,0,0]=4 5819 B12R1.100 O=CCCc1cc(Cl)cc(I)c1 Amb24368144 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.100 O=CCCc1cc(F)cc(F)c1 Amb25149927 [0,2,0,0,0,0|2,0,0]=4 5821 B12R1.100 O=CCCc1cc(F)cc(I)c1 Amb25104319 [0,2,0,0,0,0|2,0,0]=4 5822 B12R1.100 O=CCCc1cc(F)cc(S)c1 Amb24571930 [0,2,0,0,0,0|2,0,0]=4 5823 B12R1.100 O=CCOc1cc(F)cc(Br)c1 Amb25827273 [0,2,0,0,0,0|2,0,0]=4 5824 B12R1.100 O=CCOc1cc(F)cc(F)c1 Amb18802837 [0,2,0,0,0,0|2,0,0]=4 5825 B12R1.100 O=CCSc1cc(Cl)cc(Cl)c1 Amb25817384 [0,2,0,0,0,0|2,0,0]=4 5826 B12R1.100 OCCNc1cc(Cl)cc(F)c1 Amb25710763 [0,2,0,0,0,0|1,0,1]=4 5827 B12R1.226 C=C(Br)CNc1[n]c(N)cc[n]1 Amb24353120 [0,2,0,0,0,0|2,0,0]=4 5828 B12R1.226 C=C(Br)CNc1cc(Br)c[n]c1 Amb25359218 [0,2,0,0,0,0|1,0,0]=3 5829 B12R1.226 C=C(Br)CNc1cc(Br)ccc1 Amb25148623 [0,2,0,0,0,0|0,0,0]=2 5830 B12R1.226 C=C(Br)CNc1cc(Cl)[n]c[n]1 Amb25156822 [0,2,0,0,0,0|2,0,0]=4 5831 B12R1.226 C=C(Br)CNc1cc(N)cc[n]1 Amb25087399 [0,2,0,0,0,0|1,0,0]=3 5832 B12R1.226 C=C(Br)CNc1cc[n]c(N)[n]1 Amb25380769 [0,2,0,0,0,0|2,0,0]=4 5833 B12R1.226 C=C(Br)CNc1cccc(Br)[n]1 Amb25124504 [0,2,0,0,0,0|1,0,0]=3 5834 B12R1.226 C=C(Br)CNc1cccc(Cl)[n]1 Amb24398329 [0,2,0,0,0,0|1,0,0]=3 5835 B12R1.226 C=C(Br)CNc1cccc(I)c1 Amb25682772 [0,2,0,0,0,0|0,0,0]=2 5836 B12R1.226 C=C(Br)COc1c[n]cc(Cl)c1 Amb25698099 [0,2,0,0,0,0|2,0,0]=4 5837 B12R1.226 C=C(Br)COc1cccc(I)c1 Amb24456153 [0,2,0,0,0,0|1,0,0]=3 5838 B12R1.226 C=C(Br)COc1cccc(N)c1 Amb18971516 [0,2,0,0,0,0|1,0,0]=3 5839 B12R1.226 C=C(Br)CSc1cc(Br)ccc1 Amb25201938 [0,2,0,0,0,0|1,0,0]=3 5840 B12R1.226 C=C(Br)CSc1cccc(F)c1 Amb24381201 [0,2,0,0,0,0|1,0,0]=3 5841 B12R1.226 C=C(Br)CSc1cccc(N)c1 Amb25857187 [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.226 C=C(Br)CSc1cccc(O)c1 Amb25302972 [0,2,0,0,0,0|1,0,0]=3 5843 B12R1.226 C=C(Cl)CNC1=CC(=O)NC=N1 Amb25736873 [0,2,0,0,0,0|2,0,0]=4 5844 B12R1.226 C=C(Cl)CNc1[n]c(N)cc[n]1 Amb25681536 [0,2,0,0,0,0|2,0,0]=4 5845 B12R1.226 C=C(Cl)CNc1c[n]cc(Br)c1 Amb25713187 [0,2,0,0,0,0|1,0,0]=3 5846 B12R1.226 C=C(Cl)CNc1c[n]cc(Cl)[n]1 Amb25156820 [0,2,0,0,0,0|2,0,0]=4 5847 B12R1.226 C=C(Cl)CNc1cc(F)[n]c[n]1 Amb24678402 [0,2,0,0,0,0|2,0,0]=4 5848 B12R1.226 C=C(Cl)CNc1cc(N)[n]c[n]1 Amb25726575 [0,2,0,0,0,0|2,0,0]=4 5849 B12R1.226 C=C(Cl)CNc1cc(N)cc[n]1 Amb25751707 [0,2,0,0,0,0|1,0,0]=3 5850 B12R1.226 C=C(Cl)CNc1cc[n]c(Cl)[n]1 Amb25820398 [0,2,0,0,0,0|2,0,0]=4 5851 B12R1.226 C=C(Cl)CNc1cc[n]c(N)[n]1 Amb25683057 [0,2,0,0,0,0|2,0,0]=4 5852 B12R1.226 C=C(Cl)CNc1cccc(Cl)[n]1 Amb25156817 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.226 C=C(Cl)CNc1cccc(F)[n]1 Amb24442852 [0,2,0,0,0,0|1,0,0]=3 5854 B12R1.226 C=C(Cl)CNc1cccc(F)c1 Amb18969176 [0,2,0,0,0,0|0,0,0]=2 5855 B12R1.226 C=C(Cl)CNc1cccc(I)c1 Amb24644381 [0,2,0,0,0,0|0,0,0]=2 5856 B12R1.226 C=C(Cl)CNc1cccc(N)c1 Amb24469744 [0,2,0,0,0,0|0,0,0]=2 5857 B12R1.226 C=C(Cl)COc1c[n]cc(Br)c1 Amb24717643 [0,2,0,0,0,0|2,0,0]=4 5858 B12R1.226 C=C(Cl)COc1cc(Cl)ccc1 Amb24484274 [0,2,0,0,0,0|1,0,0]=3 5859 B12R1.226 C=C(Cl)COc1cccc(F)c1 Amb25340679 [0,2,0,0,0,0|1,0,0]=3 5860 B12R1.226 C=C(Cl)COc1cccc(N)c1 Amb18290028 [0,2,0,0,0,0|1,0,0]=3 5861 B12R1.226 C=C(Cl)CSc1cc(Cl)ccc1 Amb24343789 [0,2,0,0,0,0|1,0,0]=3 5862 B12R1.226 C=C(Cl)CSc1cccc(N)c1 Amb25678297 [0,2,0,0,0,0|1,0,0]=3 5863 B12R1.226 C=C(Cl)CSc1cccc(O)c1 Amb25852349 [0,2,0,0,0,0|1,0,0]=3 5864 B12R1.226 C=C(F)COc1cccc(Br)c1 Amb23570548 [0,2,0,0,0,0|1,0,0]=3 5865 B12R1.226 CC(=C)CNc1cc(Cl)[n]c[n]1 Amb24710863 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.226 CC(=C)CNc1cc(F)[n]c[n]1 Amb25772556 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.226 CC(=C)CNc1cc[n]c(Cl)c1 Amb24346580 [0,2,0,0,0,0|1,0,0]=3 5868 B12R1.226 CC(=C)CNc1cccc(Br)[n]1 Amb24553131 [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.226 CC(=C)CNc1cccc(Cl)[n]1 Amb25820399 [0,2,0,0,0,0|1,0,0]=3 5870 B12R1.226 CC(=C)CNc1cccc(N)[n]1 Amb25755555 [0,2,0,0,0,0|1,0,0]=3 5871 B12R1.226 CC(=C)CNc1cccc(N)c1 Amb24390135 [0,2,0,0,0,0|0,0,0]=2 5872 B12R1.226 CC(=C)CNc1cccc(c1)Br Amb17306224 [0,2,0,0,0,0|0,0,0]=2 5873 B12R1.226 CC(=C)CNc1cccc(c1)C Amb17306564 [0,2,0,0,0,0|0,0,0]=2 5874 B12R1.226 CC(=C)CNc1cccc(c1)Cl Amb17307143 [0,2,0,0,0,0|0,0,0]=2 5875 B12R1.226 CC(=C)CNc1cccc(c1)F Amb17306245 [0,2,0,0,0,0|0,0,0]=2 5876 B12R1.226 CC(=C)COc1cccc(Cl)c1 Amb24409848 [0,2,0,0,0,0|1,0,0]=3 5877 B12R1.226 CC(=C)COc1cccc(I)c1 Amb24582646 [0,2,0,0,0,0|1,0,0]=3 5878 B12R1.226 CC(=C)COc1cccc(c1)N Amb2081546 [0,2,0,0,0,0|1,0,0]=3 5879 B12R1.226 CC(=C)CSc1cccc(Cl)c1 Amb24355077 [0,2,0,0,0,0|1,0,0]=3 5880 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,2,0,0,0,0|1,0,1]=4 5881 B12R1.226 CC(=O)CNc1cccc(Cl)c1 Amb24626052 [0,2,0,0,0,0|0,0,1]=3 5882 B12R1.226 CC(=O)COc1cccc(Cl)c1 Amb19075144 [0,2,0,0,0,0|1,0,1]=4 5883 B12R1.226 CC(=O)COc1cccc(O)c1 Amb25053053 [0,2,0,0,0,0|1,0,1]=4 5884 B12R1.226 CC(=O)COc1cccc(c1)Br Amb17226706 [0,2,0,0,0,0|1,0,1]=4 5885 B12R1.226 CC(=O)COc1cccc(c1)N Amb17110084 [0,2,0,0,0,0|1,0,1]=4 5886 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [0,2,0,0,0,0|1,0,1]=4 5887 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [0,2,0,0,0,0|1,0,1]=4 5888 B12R1.226 CC(=O)NNc1cc(F)ccc1 Amb25036298 [0,2,0,0,0,0|1,0,1]=4 5889 B12R1.226 CC(C)=NNc1cccc(Br)c1 Amb24347596 [0,2,0,0,0,0|1,0,1]=4 5890 B12R1.226 CC(C)=NNc1cccc(Cl)c1 Amb24758717 [0,2,0,0,0,0|1,0,1]=4 5891 B12R1.226 CC(C)=NNc1cccc(F)c1 Amb25130384 [0,2,0,0,0,0|1,0,1]=4 5892 B12R1.226 CC(CNc1cccc(c1)Br)O Amb17142611 [0,2,0,0,0,0|0,0,2]=4 5893 B12R1.226 CC(CNc1cccc(c1)C)O Amb17138593 [0,2,0,0,0,0|0,0,2]=4 5894 B12R1.226 CC(CNc1cccc(c1)Cl)O Amb17139126 [0,2,0,0,0,0|0,0,2]=4 5895 B12R1.226 CC(CNc1cccc(c1)F)O Amb17138652 [0,2,0,0,0,0|0,0,2]=4 5896 B12R1.226 CC(N)CNc1cccc(Br)c1 Amb25674799 [0,2,0,0,0,0|0,0,2]=4 5897 B12R1.226 CC(O)CNc1cccc(I)c1 Amb24463052 [0,2,0,0,0,0|0,0,2]=4 5898 B12R1.226 C[C@H](O)CNc1cccc(Br)c1 Amb25373826 [0,2,0,0,0,0|0,0,2]=4 5899 B12R1.226 C[C@H](O)CNc1cccc(F)c1 Amb24708973 [0,2,0,0,0,0|0,0,2]=4 5900 B12R1.226 C[C@H](O)CNc1cccc(I)c1 Amb25717242 [0,2,0,0,0,0|0,0,2]=4 5901 B12R1.226 Cc1[n]c(cc[n]1)NCC(=C)Cl Amb25034940 [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.226 Cc1cc(CCC(N)=N)ccc1 Amb18065465 [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.226 Cc1cc(NCC(=C)Br)[n][n]c1 Amb24384840 [0,2,0,0,0,0|2,0,0]=4 5905 B12R1.226 Cc1cc(NCC(=C)Cl)[n]c[n]1 Amb25696839 [0,2,0,0,0,0|2,0,0]=4 5906 B12R1.226 Cc1cc(NCC(=C)Cl)[n]cc1 Amb24417604 [0,2,0,0,0,0|1,0,0]=3 5907 B12R1.226 Cc1cc(NCC(=O)O)ncc1 Amb10597602 [0,2,0,0,0,0|2,0,0]=4 5908 B12R1.226 Cc1cc(NCC(N)=O)[n]cc1 Amb18981408 [0,2,0,0,0,0|2,0,0]=4 5909 B12R1.226 Cc1cc(cc[n]1)NCC(=C)Br Amb23845897 [0,2,0,0,0,0|1,0,0]=3 5910 B12R1.226 Cc1cc(cc[n]1)NCC(=C)Cl Amb24342163 [0,2,0,0,0,0|1,0,0]=3 5911 B12R1.226 Cc1cc(cc[n]1)NCC(C)=C Amb24590349 [0,2,0,0,0,0|1,0,0]=3 5912 B12R1.226 Cc1cc(cc[n]1)NCC(N)=O Amb25760314 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.226 Cc1cc(cc[n]1)NCC(O)=O Amb25733691 [0,2,0,0,0,0|2,0,0]=4 5914 B12R1.226 Cc1cc(cc[n]1)OCC(C)=C Amb24525594 [0,2,0,0,0,0|2,0,0]=4 5915 B12R1.226 Cc1cc(ccc1)NCC(=C)Br Amb25122351 [0,2,0,0,0,0|0,0,0]=2 5916 B12R1.226 Cc1cc(ccc1)NCC(=C)Cl Amb18809685 [0,2,0,0,0,0|0,0,0]=2 5917 B12R1.226 Cc1cc(ccc1)NCC(F)F Amb18180317 [0,2,0,0,0,0|1,0,1]=4 5918 B12R1.226 Cc1cc(ccc1)NNC(N)=N Amb25114640 [0,2,0,0,0,0|2,0,0]=4 5919 B12R1.226 Cc1cc(ccc1)NNC(N)=O Amb25061369 [0,2,0,0,0,0|2,0,0]=4 5920 B12R1.226 Cc1cc(ccc1)OCC(=C)Br Amb25840777 [0,2,0,0,0,0|1,0,0]=3 5921 B12R1.226 Cc1cc(ccc1)OCC(=C)Cl Amb25281377 [0,2,0,0,0,0|1,0,0]=3 5922 B12R1.226 Cc1cc(ccc1)SCC(=C)Br Amb25276089 [0,2,0,0,0,0|1,0,0]=3 5923 B12R1.226 Cc1cc(ccc1)SCC(=C)Cl Amb25160448 [0,2,0,0,0,0|1,0,0]=3 5924 B12R1.226 Cc1cc(ccc1)SCC(N)=N Amb18791179 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.226 Cc1cc(ccc1)SCC(N)=S Amb25123592 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.226 Cc1cc[n]c(c1)NCC(C)=C Amb24557644 [0,2,0,0,0,0|1,0,0]=3 5927 B12R1.226 Cc1cccc(NCC(=C)Br)[n]1 Amb23845559 [0,2,0,0,0,0|1,0,0]=3 5928 B12R1.226 Cc1cccc(NCC(=C)Cl)[n]1 Amb25758421 [0,2,0,0,0,0|1,0,0]=3 5929 B12R1.226 Cc1cccc(NCC(N)=O)[n]1 Amb18289371 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.226 Cc1cccc([n]1)OCC(C)=C Amb25703298 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.226 Cc1cccc(c1)NCC(C)=O Amb25831083 [0,2,0,0,0,0|0,0,1]=3 5932 B12R1.226 Cc1cccc(c1)SCC(C)=O Amb18791171 [0,2,0,0,0,0|1,0,1]=4 5933 B12R1.226 ClC(=O)COc1cccc(c1)Br Amb16230149 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.226 ClC(=O)COc1cccc(c1)C Amb10880010 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.226 ClC(=O)CSc1cccc(c1)C Amb17143249 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.226 ClC(=O)CSc1cccc(c1)Cl Amb17143820 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.226 Clc1cncc(n1)NCC(=C)Br Amb11588869 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.226 FC(F)CNc1cccc(Br)c1 Amb25770279 [0,2,0,0,0,0|1,0,1]=4 5939 B12R1.226 FC(F)CNc1cccc(Cl)c1 Amb18320416 [0,2,0,0,0,0|1,0,1]=4 5940 B12R1.226 FC(F)CNc1cccc(I)c1 Amb24650609 [0,2,0,0,0,0|1,0,1]=4 5941 B12R1.226 Fc1cccc(c1)NCC(F)F Amb18795534 [0,2,0,0,0,0|1,0,1]=4 5942 B12R1.226 NC(=N)CCc1cccc(Br)c1 Amb18571443 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.226 NC(=N)CCc1cccc(Cl)c1 Amb18564230 [0,2,0,0,0,0|2,0,0]=4 5944 B12R1.226 NC(=N)CCc1cccc(F)c1 Amb18563720 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.226 NC(=N)CSc1cccc(Br)c1 Amb25773659 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.226 NC(=N)CSc1cccc(Cl)c1 Amb18331359 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.226 NC(=N)NNc1cc(Cl)ccc1 Amb25144113 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [0,2,0,0,0,0|2,0,0]=4 5950 B12R1.226 NC(=O)CNc1cc(Br)cc[n]1 Amb24518708 [0,2,0,0,0,0|2,0,0]=4 5951 B12R1.226 NC(=O)CNc1cc(I)ccn1 Amb10603477 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.226 NC(=O)CNc1cc[n]c(F)c1 Amb24342140 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.226 NC(=O)CNc1cccc(F)[n]1 Amb18973411 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.226 NC(=O)CNc1cccc(c1)Br Amb143565 [0,2,0,0,0,0|1,0,0]=3 5955 B12R1.226 NC(=O)COc1cccc(c1)Br Amb192032 [0,2,0,0,0,0|2,0,0]=4 5956 B12R1.226 NC(=O)COc1cccc(c1)I Amb181273 [0,2,0,0,0,0|2,0,0]=4 5957 B12R1.226 NC(=O)COc1cccc(c1)N Amb1112358 [0,2,0,0,0,0|2,0,0]=4 5958 B12R1.226 NC(=O)CSc1cccc(Br)c1 Amb25726747 [0,2,0,0,0,0|2,0,0]=4 5959 B12R1.226 NC(=O)CSc1cccc(F)c1 Amb25784013 [0,2,0,0,0,0|2,0,0]=4 5960 B12R1.226 NC(=O)CSc1cccc(O)c1 Amb25102367 [0,2,0,0,0,0|2,0,0]=4 5961 B12R1.226 NC(=O)CSc1cccc(c1)C Amb17142988 [0,2,0,0,0,0|2,0,0]=4 5962 B12R1.226 NC(=O)CSc1cccc(c1)Cl Amb17143258 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.226 NC(=S)COc1cccc(c1)[*] Amb22043508 [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.226 NC(=S)CSc1cccc(F)c1 Amb24623139 [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.226 NC(=S)NNc1cccc(c1)Br Amb2439188 [0,2,0,0,0,0|2,0,0]=4 5966 B12R1.226 NC(=S)NNc1cccc(c1)F Amb2407870 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.226 Nc1cc(NCC(O)=O)[n]cc1 Amb18295951 [0,2,0,0,0,0|2,0,0]=4 5970 B12R1.226 Nc1cc(ccc1)NCC(F)F Amb25216863 [0,2,0,0,0,0|1,0,1]=4 5971 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [0,2,0,0,0,0|1,0,0]=3 5972 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.226 Nc1cc[n]c(c1)NCC(N)=O Amb18981462 [0,2,0,0,0,0|2,0,0]=4 5974 B12R1.226 Nc1cccc(c1)OCC(N)=S Amb24439144 [0,2,0,0,0,0|2,0,0]=4 5975 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [0,2,0,0,0,0|2,0,0]=4 5976 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [0,2,0,0,0,0|2,0,0]=4 5977 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,2,0,0,0,0|2,0,0]=4 5978 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,2,0,0,0,0|2,0,0]=4 5979 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,2,0,0,0,0|2,0,0]=4 5980 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,2,0,0,0,0|2,0,0]=4 5981 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,2,0,0,0,0|2,0,0]=4 5982 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,2,0,0,0,0|2,0,0]=4 5983 B12R1.226 OC(=O)CNc1c[n]cc(Br)c1 Amb24483737 [0,2,0,0,0,0|2,0,0]=4 5984 B12R1.226 OC(=O)CNc1cc(Br)cc[n]1 Amb24343807 [0,2,0,0,0,0|2,0,0]=4 5985 B12R1.226 OC(=O)CNc1cc(Cl)cc[n]1 Amb24697669 [0,2,0,0,0,0|2,0,0]=4 5986 B12R1.226 OC(=O)CNc1cccc(Br)[n]1 Amb22899453 [0,2,0,0,0,0|2,0,0]=4 5987 B12R1.226 OC(=O)CNc1cccc(Cl)[n]1 Amb25736170 [0,2,0,0,0,0|2,0,0]=4 5988 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [0,2,0,0,0,0|1,0,0]=3 5989 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [0,2,0,0,0,0|1,0,0]=3 5990 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [0,2,0,0,0,0|2,0,0]=4 5991 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [0,2,0,0,0,0|2,0,0]=4 5993 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.382 C#CCNc1cc(CO)ccc1 Amb25034587 [0,2,0,0,0,0|0,0,2]=4 5996 B12R1.382 C#CCNc1cccc(c1)C#N Amb18958632 [0,2,0,0,0,0|0,0,2]=4 5997 B12R1.382 C#Cc1cc(ccc1)NCC#C Amb18179587 [0,2,0,0,0,0|0,0,2]=4 5998 B12R1.382 C#Cc1cc(ccc1)NCCN Amb18251584 [0,2,0,0,0,0|1,0,1]=4 5999 B12R1.382 C=CCCc1cccc(C=O)c1 Amb24085224 [0,2,0,0,0,0|1,0,0]=3 6000 B12R1.382 C=CCNc1cc(C#N)[n]cc1 Amb19000119 [0,2,0,0,0,0|1,0,0]=3 6001 B12R1.382 C=CCNc1cc(CCl)ccc1 Amb24448195 [0,2,0,0,0,0|0,0,0]=2 6002 B12R1.382 C=CCNc1cc(ccc1)C#C Amb18179740 [0,2,0,0,0,0|0,0,0]=2 6003 B12R1.382 C=CCNc1cc(ccc1)C#N Amb18295661 [0,2,0,0,0,0|0,0,0]=2 6004 B12R1.382 C=CCNc1cc[n]c(C#N)[n]1 Amb24667562 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.382 C=CCNc1cccc(C#N)[n]1 Amb25152431 [0,2,0,0,0,0|1,0,0]=3 6006 B12R1.382 C=CCNc1cccc(c1)OC Amb17306253 [0,2,0,0,0,0|0,0,0]=2 6007 B12R1.382 C=CCNc1cccc(c1)SC Amb17307263 [0,2,0,0,0,0|0,0,0]=2 6008 B12R1.382 C=CCOc1cc(C#N)[n]cc1 Amb18787948 [0,2,0,0,0,0|2,0,0]=4 6009 B12R1.382 C=CCOc1cc(ccc1)[Zn]Br Amb22897942 [0,2,0,0,0,0|1,0,0]=3 6010 B12R1.382 C=CCOc1cccc(c1)C=O Amb1227717 [0,2,0,0,0,0|1,0,0]=3 6011 B12R1.382 C=CCOc1cccc(c1)CN Amb16233827 [0,2,0,0,0,0|1,0,0]=3 6012 B12R1.382 C=CCSc1cc(C#N)[n]cc1 Amb25356723 [0,2,0,0,0,0|2,0,0]=4 6013 B12R1.382 C=CCSc1cc(cc[n]1)C#N Amb25106959 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.382 C=CCSc1cccc(C#N)[n]1 Amb24353296 [0,2,0,0,0,0|2,0,0]=4 6015 B12R1.382 C=CCSc1cccc(NN)[n]1 Amb25313772 [0,2,0,0,0,0|2,0,0]=4 6016 B12R1.382 C=C\C=C/c1cccc(C=O)c1 Amb24085624 [0,2,0,0,0,0|1,0,1]=4 6017 B12R1.382 C=C\C=C\c1cccc(C=O)c1 Amb24085615 [0,2,0,0,0,0|1,0,1]=4 6018 B12R1.382 CCc1cc(NCC=C)[n]c[n]1 Amb18792504 [0,2,0,0,0,0|2,0,0]=4 6019 B12R1.382 CCc1cc(cc[n]1)NCC=C Amb24355512 [0,2,0,0,0,0|1,0,0]=3 6020 B12R1.382 CCc1cc(ccc1)NCC#C Amb18800156 [0,2,0,0,0,0|0,0,2]=4 6021 B12R1.382 CCc1cc(ccc1)NCC=C Amb18792395 [0,2,0,0,0,0|0,0,0]=2 6022 B12R1.382 CCc1cc(ccc1)OCC=C Amb22266027 [0,2,0,0,0,0|1,0,0]=3 6023 B12R1.382 CNc1cc(cc[n]1)OCC=C Amb24642338 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.382 CNc1cc(ccc1)OCC=C Amb23539741 [0,2,0,0,0,0|1,0,0]=3 6025 B12R1.382 COCNc1cc(ccc1)C#N Amb24696464 [0,2,0,0,0,0|1,0,1]=4 6026 B12R1.382 COc1cc(NCC=C)[n]c[n]1 Amb18854298 [0,2,0,0,0,0|2,0,0]=4 6027 B12R1.382 COc1cc(ccc1)NCC#C Amb18985944 [0,2,0,0,0,0|0,0,2]=4 6028 B12R1.382 COc1cc(ccc1)NCCF Amb24435276 [0,2,0,0,0,0|1,0,1]=4 6029 B12R1.382 COc1cc(ccc1)NCCS Amb25667359 [0,2,0,0,0,0|1,0,1]=4 6030 B12R1.382 COc1cc(ccc1)NCOC Amb24102348 [0,2,0,0,0,0|1,0,1]=4 6031 B12R1.382 COc1cccc(NCC=C)[n]1 Amb25796552 [0,2,0,0,0,0|1,0,0]=3 6032 B12R1.382 COc1cccc(\C=C\C=C)c1 Amb24612051 [0,2,0,0,0,0|1,0,1]=4 6033 B12R1.382 CSc1cc(NCC=C)[n]c[n]1 Amb25806487 [0,2,0,0,0,0|2,0,0]=4 6034 B12R1.382 CSc1cc(ccc1)NCC#C Amb18809001 [0,2,0,0,0,0|0,0,2]=4 6035 B12R1.382 ClCCNc1cccc(c1)C#N Amb17335461 [0,2,0,0,0,0|1,0,1]=4 6036 B12R1.382 ClCCNc1cccc(c1)OC Amb17335807 [0,2,0,0,0,0|1,0,1]=4 6037 B12R1.382 N#Cc1cc(CCC=O)ccc1 Amb18645176 [0,2,0,0,0,0|2,0,0]=4 6038 B12R1.382 N#Cc1cc(ccc1)OCC=O Amb18800496 [0,2,0,0,0,0|2,0,0]=4 6039 B12R1.382 NCCNc1cc(ccc1)C#N Amb18992217 [0,2,0,0,0,0|1,0,1]=4 6040 B12R1.382 NCCNc1cccc(c1)OC Amb17057754 [0,2,0,0,0,0|1,0,1]=4 6041 B12R1.8 BrCCCNCc1ccccc1 Amb18134994 [0,2,0,0,0,0|0,0,2]=4 6042 B12R1.8 BrC\C=C\C=Cc1ccccc1 Amb25731131 [0,2,0,0,0,0|1,0,1]=4 6043 B12R1.8 C#CCNOCc1ccccc1 Amb25282219 [0,2,0,0,0,0|0,0,2]=4 6044 B12R1.8 C#CCONCc1ccccc1 Amb24444637 [0,2,0,0,0,0|0,0,2]=4 6045 B12R1.8 C=C=CCNCc1ccccc1 Amb25775091 [0,2,0,0,0,0|0,0,0]=2 6046 B12R1.8 C=CC#CCNc1ccccc1 Amb24728218 [0,2,0,0,0,0|0,0,0]=2 6047 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [0,2,0,0,0,0|1,0,0]=3 6048 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [0,2,0,0,0,0|0,0,0]=2 6049 B12R1.8 C=CCN\C=N\c1ccccc1 Amb25105373 [0,2,0,0,0,0|0,0,0]=2 6050 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [0,2,0,0,0,0|0,0,0]=2 6051 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.8 C=C\C=C\CNc1ccccc1 Amb25312011 [0,2,0,0,0,0|0,0,0]=2 6053 B12R1.8 C=C\C=C\NCc1ccccc1 Amb24512239 [0,2,0,0,0,0|0,0,1]=3 6054 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [0,2,0,0,0,0|0,0,2]=4 6055 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [0,2,0,0,0,0|0,0,2]=4 6056 B12R1.8 CCCN\C=C\c1ccccc1 Amb24565827 [0,2,0,0,0,0|0,0,2]=4 6057 B12R1.8 CCCONCc1ccccc1 Amb25031180 [0,2,0,0,0,0|0,0,2]=4 6058 B12R1.8 CCNCCNc1ccccc1 Amb18792597 [0,2,0,0,0,0|0,0,2]=4 6059 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [0,2,0,0,0,0|0,0,2]=4 6060 B12R1.8 CC\C=C\CNc1c[n]cc[n]1 Amb24536492 [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.8 CC\C=C\CNc1cc[n]c[n]1 Amb24662143 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.8 CC\C=C\CNc1ccc[n][n]1 Amb24570640 [0,2,0,0,0,0|2,0,0]=4 6063 B12R1.8 CC\C=C\NCc1ccccc1 Amb24519259 [0,2,0,0,0,0|0,0,2]=4 6064 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [0,2,0,0,0,0|0,0,2]=4 6065 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|0,0,2]=4 6066 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [0,2,0,0,0,0|0,0,2]=4 6067 B12R1.8 CS\C=C/CNc1ccccc1 Amb25312228 [0,2,0,0,0,0|0,0,0]=2 6068 B12R1.8 CS\C=C\CNc1ccccc1 Amb25167583 [0,2,0,0,0,0|0,0,0]=2 6069 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [0,2,0,0,0,0|0,0,0]=2 6070 B12R1.8 ClCC#CCNc1ccccc1 Amb24652633 [0,2,0,0,0,0|0,0,2]=4 6071 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [0,2,0,0,0,0|0,0,2]=4 6072 B12R1.8 ClC\C=C\C=C\c1ccccc1 Amb25723712 [0,2,0,0,0,0|1,0,1]=4 6073 B12R1.8 ClC\C=C\C=Cc1ccccc1 Amb25677867 [0,2,0,0,0,0|1,0,1]=4 6074 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [0,2,0,0,0,0|1,0,0]=3 6075 B12R1.8 N#CCCNNc1ccccc1 Amb17594020 [0,2,0,0,0,0|0,0,2]=4 6076 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [0,2,0,0,0,0|1,0,0]=3 6077 B12R1.8 N#C\C=C\COc1cccc[n]1 Amb25816793 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.8 N#C\C=C\NCc1ccccc1 Amb25072771 [0,2,0,0,0,0|0,0,2]=4 6079 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [0,2,0,0,0,0|0,0,2]=4 6080 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,2,0,0,0,0|1,0,1]=4 6081 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [0,2,0,0,0,0|1,0,1]=4 6082 B12R1.8 NC\C=C/C=C/c1ccccc1 Amb25199167 [0,2,0,0,0,0|1,0,1]=4 6083 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb10567259 [0,2,0,0,0,0|1,0,1]=4 6084 B12R1.8 NC\C=C\CNc1c[n]cc[n]1 Amb25374647 [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.8 NC\C=C\CNc1cccc[n]1 Amb25724555 [0,2,0,0,0,0|1,0,0]=3 6086 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [0,2,0,0,0,0|0,0,0]=2 6087 B12R1.8 O=CC#CCCc1ccccc1 Amb24356095 [0,2,0,0,0,0|1,0,1]=4 6088 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|1,0,1]=4 6089 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|1,0,1]=4 6090 B12R1.8 O=CCOCCc1ccccc1 Amb18800786 [0,2,0,0,0,0|1,0,1]=4 6091 B12R1.8 O=CNCNCc1ccccc1 Amb24532665 [0,2,0,0,0,0|1,0,0]=3 6092 B12R1.8 O=CNCOCc1ccccc1 Amb24552397 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.8 O=CNC\C=C\c1ccccc1 Amb25249766 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [0,2,0,0,0,0|1,0,1]=4 6095 B12R1.8 O=C\C=C\C#Cc1ccccc1 Amb24697813 [0,2,0,0,0,0|1,0,1]=4 6096 B12R1.8 O=C\C=C\C=C/c1ccccc1 Amb24453384 [0,2,0,0,0,0|1,0,1]=4 6097 B12R1.8 O=C\C=C\C=C\c1ccccc1 Amb17593956 [0,2,0,0,0,0|1,0,1]=4 6098 B12R1.8 O=C\C=C\N=C\c1ccccc1 Amb25827583 [0,2,0,0,0,0|0,0,2]=4 6099 B12R1.8 O=C\C=C\N=Cc1ccccc1 Amb24741714 [0,2,0,0,0,0|0,0,2]=4 6100 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [0,2,0,0,0,0|0,0,1]=3 6101 B12R1.8 O=C\C=C\OCc1ccccc1 Amb18645661 [0,2,0,0,0,0|1,0,1]=4 6102 B12R1.8 O=C\C=N\OCc1ccccc1 Amb24540826 [0,2,0,0,0,0|2,0,0]=4 6103 B12R1.8 OCC#CCNc1ccccc1 Amb25758889 [0,2,0,0,0,0|0,0,2]=4 6104 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|0,0,2]=4 6105 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [0,2,0,0,0,0|1,0,1]=4 6106 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|1,0,1]=4 6107 B12R1.8 OCC\C=N\Nc1ccccc1 Amb25846258 [0,2,0,0,0,0|1,0,1]=4 6108 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|1,0,1]=4 6109 B12R1.8 OC\C=C\C=Cc1ccccc1 Amb24700798 [0,2,0,0,0,0|1,0,1]=4 6110 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [0,2,0,0,0,0|1,0,0]=3 6111 B12R1.8 SCCCNCc1ccccc1 Amb25751336 [0,2,0,0,0,0|0,0,2]=4 6112 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,2,0,0,0,0|1,0,1]=4 6113 B12R1.27 C#CC(=O)CNc1ccccc1 Amb24359731 [0,2,0,0,0,0|0,0,1]=3 6114 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [0,2,0,0,0,0|1,0,1]=4 6115 B12R1.27 C=C(C=O)C#Cc1ccccc1 Amb25821448 [0,2,0,0,0,0|1,0,1]=4 6116 B12R1.27 C=C(C=O)ONc1ccccc1 Amb24676829 [0,2,0,0,0,0|1,0,0]=3 6117 B12R1.27 C=C(CNc1cccc[n]1)C#N Amb24624033 [0,2,0,0,0,0|1,0,0]=3 6118 B12R1.27 C=C(CNc1ccccc1)C#N Amb18645075 [0,2,0,0,0,0|0,0,0]=2 6119 B12R1.27 C=C(CO)C#Cc1ccccc1 Amb24497788 [0,2,0,0,0,0|1,0,1]=4 6120 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [0,2,0,0,0,0|0,0,0]=2 6121 B12R1.27 C=C(COc1ccccc1)C#N Amb25739080 [0,2,0,0,0,0|1,0,0]=3 6122 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,2,0,0,0,0|1,0,0]=3 6123 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,2,0,0,0,0|0,0,1]=3 6124 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,2,0,0,0,0|1,0,1]=4 6125 B12R1.27 C=CC(O)CSc1ccccc1 Amb24273355 [0,2,0,0,0,0|1,0,0]=3 6126 B12R1.27 C=C[C@@H](O)C#Cc1ccccc1 Amb25817128 [0,2,0,0,0,0|1,0,0]=3 6127 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [0,2,0,0,0,0|1,0,1]=4 6128 B12R1.27 CC(C=O)=C=Cc1ccccc1 Amb24452570 [0,2,0,0,0,0|1,0,1]=4 6129 B12R1.27 CC(C=O)C#Cc1ccccc1 Amb25075672 [0,2,0,0,0,0|2,0,0]=4 6130 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|2,0,0]=4 6131 B12R1.27 CC(C=O)ONc1ccccc1 Amb25239411 [0,2,0,0,0,0|1,0,0]=3 6132 B12R1.27 CC(C=O)\C=C\c1ccccc1 Amb24573489 [0,2,0,0,0,0|2,0,0]=4 6133 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,2,0,0,0,0|0,0,2]=4 6134 B12R1.27 CC(CF)NCc1ccccc1 Amb24536598 [0,2,0,0,0,0|1,0,1]=4 6135 B12R1.27 CC(CN)CNc1ccccc1 Amb19027860 [0,2,0,0,0,0|0,0,2]=4 6136 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,2,0,0,0,0|1,0,1]=4 6137 B12R1.27 CC(CNc1ccccc1)C=C Amb25080486 [0,2,0,0,0,0|0,0,0]=2 6138 B12R1.27 CC(CNc1ccccc1)NN Amb18646401 [0,2,0,0,0,0|0,0,2]=4 6139 B12R1.27 CCC(=C)CNc1[n]ccc[n]1 Amb25108774 [0,2,0,0,0,0|2,0,0]=4 6140 B12R1.27 CCC(=C)CNc1cc[n]c[n]1 Amb24339367 [0,2,0,0,0,0|2,0,0]=4 6141 B12R1.27 CCC(=C)CNc1ccc[n][n]1 Amb25101132 [0,2,0,0,0,0|2,0,0]=4 6142 B12R1.27 CCC(=C)CNc1cccc[n]1 Amb24677972 [0,2,0,0,0,0|1,0,0]=3 6143 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,2,0,0,0,0|0,0,0]=2 6144 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [0,2,0,0,0,0|0,0,2]=4 6145 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,2,0,0,0,0|0,0,2]=4 6146 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [0,2,0,0,0,0|0,0,2]=4 6147 B12R1.27 CN(CNc1ccccc1)N=O Amb25690722 [0,2,0,0,0,0|1,0,1]=4 6148 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,2,0,0,0,0|1,0,1]=4 6149 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [0,2,0,0,0,0|1,0,1]=4 6150 B12R1.27 CNC(=N)NNc1ccccc1 Amb25227942 [0,2,0,0,0,0|1,0,1]=4 6151 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,2,0,0,0,0|1,0,1]=4 6152 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [0,2,0,0,0,0|0,0,2]=4 6153 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,2,0,0,0,0|0,0,1]=3 6154 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,2,0,0,0,0|1,0,1]=4 6155 B12R1.27 COC(=O)CNc1ccc[n]c1 Amb18270093 [0,2,0,0,0,0|1,0,1]=4 6156 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,2,0,0,0,0|0,0,2]=4 6157 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,2,0,0,0,0|0,0,2]=4 6158 B12R1.27 CSC([S-])=NNc1ccccc1 Amb22446044 [0,2,0,0,0,0|1,0,1]=4 6159 B12R1.27 CSC([S-])=NNc1ccccc1 Amb22446069 [0,2,0,0,0,0|1,0,1]=4 6160 B12R1.27 C[C@@H](C=O)ONc1ccccc1 Amb25701904 [0,2,0,0,0,0|1,0,0]=3 6161 B12R1.27 C[C@@H](C=O)\C=C\c1ccccc1 Amb24441531 [0,2,0,0,0,0|2,0,0]=4 6162 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,2,0,0,0,0|1,0,1]=4 6163 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|1,0,1]=4 6164 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|1,0,1]=4 6166 B12R1.27 C[C@H](CO)ONc1ccccc1 Amb24625280 [0,2,0,0,0,0|1,0,1]=4 6167 B12R1.27 C\C(=C/Nc1ccccc1)\C#N Amb25800178 [0,2,0,0,0,0|0,0,2]=4 6168 B12R1.27 C\C(=C\O)\C#Cc1ccccc1 Amb24379979 [0,2,0,0,0,0|1,0,1]=4 6169 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [0,2,0,0,0,0|1,0,1]=4 6170 B12R1.27 C\C(\C=O)=C/Nc1ccccc1 Amb18645511 [0,2,0,0,0,0|0,0,1]=3 6171 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [0,2,0,0,0,0|1,0,1]=4 6172 B12R1.27 C\C(\C=O)=C\Sc1ccccc1 Amb25277189 [0,2,0,0,0,0|1,0,1]=4 6173 B12R1.27 C\C(\C=O)=N/Nc1ccccc1 Amb18645673 [0,2,0,0,0,0|1,0,0]=3 6174 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,2,0,0,0,0|1,0,1]=4 6175 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [0,2,0,0,0,0|0,0,0]=2 6176 B12R1.27 C\C(\CO)=N\Nc1ccccc1 Amb24619168 [0,2,0,0,0,0|1,0,1]=4 6177 B12R1.27 C\C(\COc1ccc[n]c1)=C\Cl Amb25137949 [0,2,0,0,0,0|2,0,0]=4 6178 B12R1.27 C\C(\COc1ccccc1)=C\Cl Amb25241242 [0,2,0,0,0,0|1,0,0]=3 6179 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|1,0,1]=4 6180 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|1,0,1]=4 6181 B12R1.27 ClCC(CNc1ccccc1)O Amb10565986 [0,2,0,0,0,0|0,0,2]=4 6182 B12R1.27 Cl\C(\C=Cc1ccccc1)=C\Cl Amb25179203 [0,2,0,0,0,0|1,0,1]=4 6183 B12R1.27 Cl\C(\COc1c[n]ccc1)=C\Cl Amb24655423 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.27 Cl\C(\CSc1cccc[n]1)=C\Cl Amb24676484 [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.27 Cl\C(\CSc1ccccc1)=C\Cl Amb24496037 [0,2,0,0,0,0|1,0,0]=3 6186 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,2,0,0,0,0|1,0,1]=4 6187 B12R1.27 N#CC(Cl)CNc1ccccc1 Amb18648453 [0,2,0,0,0,0|0,0,2]=4 6188 B12R1.27 NC(CO)CNc1ccccc1 Amb25674165 [0,2,0,0,0,0|0,0,2]=4 6189 B12R1.27 NC(COc1ccccc1)=NN Amb18788366 [0,2,0,0,0,0|2,0,0]=4 6190 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|1,0,1]=4 6191 B12R1.27 NCC(=O)NNc1ccccc1 Amb18646327 [0,2,0,0,0,0|1,0,1]=4 6192 B12R1.27 NCC(CNc1ccccc1)O Amb17138613 [0,2,0,0,0,0|0,0,2]=4 6193 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,2,0,0,0,0|2,0,0]=4 6194 B12R1.27 NNC(=O)CNc1cccc[n]1 Amb25187500 [0,2,0,0,0,0|2,0,0]=4 6195 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,2,0,0,0,0|1,0,0]=3 6196 B12R1.27 NNC(=S)NNc1ccccc1 Amb24502103 [0,2,0,0,0,0|2,0,0]=4 6197 B12R1.27 NSC(=S)NNc1ccccc1 Amb10844769 [0,2,0,0,0,0|2,0,0]=4 6198 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,2,0,0,0,0|2,0,0]=4 6199 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|2,0,0]=4 6200 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,2,0,0,0,0|1,0,0]=3 6201 B12R1.27 N\C(\NNc1ccccc1)=N\O Amb24485684 [0,2,0,0,0,0|2,0,0]=4 6202 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [0,2,0,0,0,0|2,0,0]=4 6203 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|1,0,1]=4 6204 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|1,0,1]=4 6205 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [0,2,0,0,0,0|1,0,1]=4 6206 B12R1.27 O=C(\C=C\c1ccccc1)C=O Amb18126247 [0,2,0,0,0,0|1,0,1]=4 6207 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [0,2,0,0,0,0|1,0,1]=4 6208 B12R1.27 O=CC(Cl)\C=N\c1ccccc1 Amb24433968 [0,2,0,0,0,0|1,0,1]=4 6209 B12R1.27 O=CC(\C=N\c1ccccc1)Br Amb2233921 [0,2,0,0,0,0|1,0,1]=4 6210 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [0,2,0,0,0,0|2,0,0]=4 6211 B12R1.27 O=C\C(\Cl)=C/Nc1ccccc1 Amb24603974 [0,2,0,0,0,0|0,0,1]=3 6212 B12R1.27 O=C\C(\Cl)=C\Nc1ccccc1 Amb25797781 [0,2,0,0,0,0|0,0,1]=3 6213 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [0,2,0,0,0,0|1,0,1]=4 6214 B12R1.27 O=C\C(\F)=N/Nc1ccccc1 Amb24611193 [0,2,0,0,0,0|1,0,0]=3 6215 B12R1.27 OC(C=O)C#Cc1ccccc1 Amb25375035 [0,2,0,0,0,0|2,0,0]=4 6216 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|1,0,1]=4 6217 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|1,0,1]=4 6218 B12R1.27 OCC(CNc1ccccc1)O Amb17307124 [0,2,0,0,0,0|0,0,2]=4 6219 B12R1.27 OC[C@@H](O)CNc1ccccc1 Amb18792912 [0,2,0,0,0,0|0,0,2]=4 6220 B12R1.27 O[C@H](CCl)CNc1ccccc1 Amb24426200 [0,2,0,0,0,0|0,0,2]=4 6221 B12R1.27 O\C(\C=O)=C/Nc1ccccc1 Amb25187506 [0,2,0,0,0,0|0,0,1]=3 6222 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,2,0,0,0,0|2,0,0]=4 6223 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,2,0,0,0,0|2,0,0]=4 6224 B12R1.27 [NH4]SC(=S)NNc1ccccc1 Amb22346081 [0,2,0,0,0,0|2,0,0]=4 6225 B12R1.32 BrCCC(=O)Nc1ccccc1 Amb16191990 [0,2,0,0,0,0|1,0,1]=4 6226 B12R1.32 C=C(\C=C\Cl)Sc1ccccc1 Amb24635686 [0,2,0,0,0,0|1,0,1]=4 6227 B12R1.32 C=C=CC(=O)Cc1ccccc1 Amb25713668 [0,2,0,0,0,0|1,0,1]=4 6228 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [0,2,0,0,0,0|1,0,0]=3 6229 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [0,2,0,0,0,0|1,0,0]=3 6230 B12R1.32 C=CCC(=O)Nc1cccc[n]1 Amb25159304 [0,2,0,0,0,0|1,0,0]=3 6231 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,2,0,0,0,0|0,0,0]=2 6232 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [0,2,0,0,0,0|1,0,0]=3 6233 B12R1.32 C=CCC(Nc1ccccn1)C Amb10554010 [0,2,0,0,0,0|1,0,0]=3 6234 B12R1.32 C=CNC(=O)Nc1cccc[n]1 Amb25685997 [0,2,0,0,0,0|1,0,1]=4 6235 B12R1.32 C=CNC(=O)Oc1ccccc1 Amb25159436 [0,2,0,0,0,0|1,0,1]=4 6236 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,2,0,0,0,0|1,0,1]=4 6237 B12R1.32 C=NNC(=O)Nc1ccccc1 Amb24488786 [0,2,0,0,0,0|1,0,1]=4 6238 B12R1.32 C=NOC(=O)Nc1ccccc1 Amb24420620 [0,2,0,0,0,0|1,0,1]=4 6239 B12R1.32 CC#CC(C)Nc1ccccc1 Amb25040061 [0,2,0,0,0,0|0,0,2]=4 6240 B12R1.32 CC(CC=C)Nc1cc[n]c[n]1 Amb24367060 [0,2,0,0,0,0|2,0,0]=4 6241 B12R1.32 CC(CC=C)Nc1cc[n]cc1 Amb24585041 [0,2,0,0,0,0|1,0,0]=3 6242 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [0,2,0,0,0,0|1,0,1]=4 6243 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [0,2,0,0,0,0|2,0,0]=4 6244 B12R1.32 CC(Nc1ccccc1)CC#N Amb17138511 [0,2,0,0,0,0|0,0,2]=4 6245 B12R1.32 CCCC(=N)Nc1ccccc1 Amb24096810 [0,2,0,0,0,0|0,0,2]=4 6246 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [0,2,0,0,0,0|0,0,2]=4 6247 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,2,0,0,0,0|1,0,0]=3 6248 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,2,0,0,0,0|1,0,1]=4 6249 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,2,0,0,0,0|1,0,1]=4 6250 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [0,2,0,0,0,0|1,0,1]=4 6251 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [0,2,0,0,0,0|1,0,1]=4 6252 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,2,0,0,0,0|0,0,2]=4 6253 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,2,0,0,0,0|1,0,1]=4 6254 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [0,2,0,0,0,0|0,0,2]=4 6255 B12R1.32 C[C@@H](CC#N)Nc1ccccc1 Amb25301483 [0,2,0,0,0,0|0,0,2]=4 6256 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,2,0,0,0,0|0,0,2]=4 6257 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [0,2,0,0,0,0|2,0,0]=4 6258 B12R1.32 C[C@H](CC#N)Nc1ccccc1 Amb24459585 [0,2,0,0,0,0|0,0,2]=4 6259 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,2,0,0,0,0|0,0,2]=4 6260 B12R1.32 C\C(=C/C=O)\Nc1ccccc1 Amb18645507 [0,2,0,0,0,0|0,0,1]=3 6261 B12R1.32 C\C(=C/C=O)\Oc1ccccc1 Amb25326052 [0,2,0,0,0,0|1,0,1]=4 6262 B12R1.32 C\C(=C/C=O)\Sc1ccccc1 Amb18648150 [0,2,0,0,0,0|1,0,1]=4 6263 B12R1.32 C\C(=C\C=O)\Nc1ccccc1 Amb24611198 [0,2,0,0,0,0|0,0,1]=3 6264 B12R1.32 C\C(=C\CC)\Nc1ccccc1 Amb25678437 [0,2,0,0,0,0|0,0,2]=4 6265 B12R1.32 C\C(\CC=O)=C/c1ccccc1 Amb18126261 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [0,2,0,0,0,0|1,0,1]=4 6267 B12R1.32 C\C=C\C(=O)Nc1cccc[n]1 Amb25785202 [0,2,0,0,0,0|1,0,1]=4 6268 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb24497299 [0,2,0,0,0,0|0,0,1]=3 6269 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,2,0,0,0,0|1,0,0]=3 6270 B12R1.32 C\C=C\C(O)Cc1cccc[n]1 Amb25221506 [0,2,0,0,0,0|2,0,0]=4 6271 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,2,0,0,0,0|1,0,0]=3 6272 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,2,0,0,0,0|1,0,0]=3 6273 B12R1.32 N#CCC(=O)Nc1ccccc1 Amb1634628 [0,2,0,0,0,0|1,0,1]=4 6274 B12R1.32 N#CCC(=S)Nc1ccccc1 Amb1980796 [0,2,0,0,0,0|1,0,1]=4 6275 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|1,0,1]=4 6276 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|1,0,1]=4 6277 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,2,0,0,0,0|1,0,1]=4 6278 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,2,0,0,0,0|2,0,0]=4 6279 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [0,2,0,0,0,0|0,0,2]=4 6280 B12R1.32 O=C(CCF)Nc1ccccc1 Amb25276540 [0,2,0,0,0,0|1,0,1]=4 6281 B12R1.32 O=C(CCI)Nc1ccccc1 Amb23447340 [0,2,0,0,0,0|1,0,1]=4 6282 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [0,2,0,0,0,0|1,0,1]=4 6283 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [0,2,0,0,0,0|1,0,1]=4 6284 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,2,0,0,0,0|0,0,1]=3 6285 B12R1.32 OC(CCCl)Nc1ccccc1 Amb24635759 [0,2,0,0,0,0|0,0,2]=4 6286 B12R1.32 OCCC(O)Nc1ccccc1 Amb25060097 [0,2,0,0,0,0|0,0,2]=4 6287 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,2,0,0,0,0|1,0,1]=4 6288 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,2,0,0,0,0|2,0,0]=4 6289 B12R1.32 O\C=C/C(=S)Nc1ccccc1 Amb24495245 [0,2,0,0,0,0|0,0,1]=3 6290 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [0,2,0,0,0,0|1,0,1]=4 6291 B12R1.32 O\C=C\C(=S)Nc1ccccc1 Amb24592387 [0,2,0,0,0,0|0,0,1]=3 6292 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [0,2,0,0,0,0|1,0,1]=4 6293 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.32 SCCC(=O)Nc1ccccc1 Amb17305724 [0,2,0,0,0,0|1,0,1]=4 6295 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [0,2,0,0,0,0|1,0,1]=4 6296 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,2,0,0,0,0|0,0,2]=4 6297 B12R1.32 [C-]#[N+]CC(=O)Nc1ccccc1 Amb25695864 [0,2,0,0,0,0|1,0,1]=4 6298 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [0,2,0,0,0,0|0,0,0]=2 6299 B12R1.252 BrC(Br)=CC#Cc1ccccc1 Amb25158034 [0,2,0,0,0,0|1,0,1]=4 6300 B12R1.252 BrC(Br)=CC=Cc1ccccc1 Amb24698537 [0,2,0,0,0,0|1,0,1]=4 6301 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,2,0,0,0,0|1,0,0]=3 6302 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [0,2,0,0,0,0|0,0,0]=2 6303 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [0,2,0,0,0,0|0,0,0]=2 6304 B12R1.252 CC(=C)CCNc1cccc[n]1 Amb25273311 [0,2,0,0,0,0|1,0,0]=3 6305 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [0,2,0,0,0,0|0,0,0]=2 6306 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [0,2,0,0,0,0|0,0,0]=2 6307 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [0,2,0,0,0,0|0,0,0]=2 6308 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [0,2,0,0,0,0|1,0,1]=4 6309 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,2,0,0,0,0|1,0,1]=4 6310 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [0,2,0,0,0,0|0,0,2]=4 6311 B12R1.252 CC(=O)\C=C/Nc1cccc[n]1 Amb24513633 [0,2,0,0,0,0|1,0,1]=4 6312 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb10565265 [0,2,0,0,0,0|1,0,1]=4 6313 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb25735703 [0,2,0,0,0,0|1,0,1]=4 6314 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [0,2,0,0,0,0|1,0,1]=4 6315 B12R1.252 CC(=O)\C=C\Nc1cccc[n]1 Amb22490408 [0,2,0,0,0,0|1,0,1]=4 6316 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,2,0,0,0,0|0,0,1]=3 6317 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb25179665 [0,2,0,0,0,0|1,0,1]=4 6318 B12R1.252 CC(=O)\C=N/Nc1ccccc1 Amb11012875 [0,2,0,0,0,0|1,0,0]=3 6319 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [0,2,0,0,0,0|1,0,0]=3 6320 B12R1.252 CC(=S)\C=C\Nc1ccccc1 Amb25732011 [0,2,0,0,0,0|0,0,1]=3 6321 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,2,0,0,0,0|1,0,0]=3 6322 B12R1.252 CC(C)=CCNc1c[n]cc[n]1 Amb25060544 [0,2,0,0,0,0|2,0,0]=4 6323 B12R1.252 CC(C)=CCNc1cc[n]c[n]1 Amb25091272 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.252 CC(C)=CCNc1ccc[n][n]1 Amb25728040 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.252 CC(C)=CCOc1c[n]ccc1 Amb25314117 [0,2,0,0,0,0|2,0,0]=4 6326 B12R1.252 CC(C)=CCOc1cc[n]cc1 Amb24459254 [0,2,0,0,0,0|2,0,0]=4 6327 B12R1.252 CC(C)=CCOc1cccc[n]1 Amb25822848 [0,2,0,0,0,0|2,0,0]=4 6328 B12R1.252 CC(C)=C\C=C\c1ccccc1 Amb22347651 [0,2,0,0,0,0|1,0,1]=4 6329 B12R1.252 CC(C)=NNCc1ccccc1 Amb24421246 [0,2,0,0,0,0|1,0,1]=4 6330 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,2,0,0,0,0|0,0,2]=4 6331 B12R1.252 CC(C)\C=C\Nc1ccccc1 Amb25844091 [0,2,0,0,0,0|0,0,2]=4 6332 B12R1.252 CC(C)\C=N\Nc1ccccc1 Amb25049375 [0,2,0,0,0,0|1,0,1]=4 6333 B12R1.252 CC(F)CNCc1ccccc1 Amb25795376 [0,2,0,0,0,0|0,0,2]=4 6334 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,2,0,0,0,0|0,0,2]=4 6335 B12R1.252 CC(N)CNCc1ccccc1 Amb18305296 [0,2,0,0,0,0|0,0,2]=4 6336 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,2,0,0,0,0|0,0,2]=4 6337 B12R1.252 CC(O)CNNc1ccccc1 Amb24719484 [0,2,0,0,0,0|0,0,2]=4 6338 B12R1.252 CC(O)\C=N\Nc1ccccc1 Amb25816526 [0,2,0,0,0,0|1,0,1]=4 6339 B12R1.252 CC(S)CNCc1ccccc1 Amb18648551 [0,2,0,0,0,0|0,0,2]=4 6340 B12R1.252 CN(N)CCNc1ccccc1 Amb18646399 [0,2,0,0,0,0|0,0,2]=4 6341 B12R1.252 CN(\C=[NH+]\Nc1ccccc1)C Amb10569623 [0,2,0,0,0,0|1,0,1]=4 6342 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [0,2,0,0,0,0|0,0,2]=4 6343 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,2,0,0,0,0|0,0,2]=4 6344 B12R1.252 C[C@@H](O)\C=N\Nc1ccccc1 Amb24608055 [0,2,0,0,0,0|1,0,1]=4 6345 B12R1.252 C[C@H](N)CNCc1ccccc1 Amb25047295 [0,2,0,0,0,0|0,0,2]=4 6346 B12R1.252 C[C@H](O)\C=N\Nc1ccccc1 Amb25816090 [0,2,0,0,0,0|1,0,1]=4 6347 B12R1.252 C\C(\N)=C\C=Nc1ccccc1 Amb25200020 [0,2,0,0,0,0|0,0,2]=4 6348 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|1,0,1]=4 6349 B12R1.252 ClC(Cl)=CCNc1ccccc1 Amb25160645 [0,2,0,0,0,0|0,0,0]=2 6350 B12R1.252 FC(CNCc1ccccc1)F Amb16229911 [0,2,0,0,0,0|1,0,1]=4 6351 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [0,2,0,0,0,0|1,0,0]=3 6352 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [0,2,0,0,0,0|2,0,0]=4 6353 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [0,2,0,0,0,0|2,0,0]=4 6354 B12R1.252 NC(=N)NNCc1ccccc1 Amb10553070 [0,2,0,0,0,0|2,0,0]=4 6355 B12R1.252 NC(=N)NNCc1ccccc1 Amb18563641 [0,2,0,0,0,0|2,0,0]=4 6356 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [0,2,0,0,0,0|2,0,0]=4 6357 B12R1.252 NC(=O)CCNc1ccc[n]c1 Amb25241565 [0,2,0,0,0,0|1,0,1]=4 6358 B12R1.252 NC(=O)CNCc1cccnc1 Amb10609111 [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [0,2,0,0,0,0|2,0,0]=4 6360 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [0,2,0,0,0,0|2,0,0]=4 6361 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.252 NC(=O)C\N=C\c1ccccc1 Amb24485689 [0,2,0,0,0,0|1,0,1]=4 6363 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,2,0,0,0,0|2,0,0]=4 6364 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [0,2,0,0,0,0|2,0,0]=4 6365 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [0,2,0,0,0,0|1,0,1]=4 6366 B12R1.252 NC(=O)\C=N\Nc1ccccc1 Amb25241203 [0,2,0,0,0,0|1,0,0]=3 6367 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [0,2,0,0,0,0|0,0,1]=3 6368 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,2,0,0,0,0|1,0,1]=4 6369 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [0,2,0,0,0,0|1,0,0]=3 6370 B12R1.252 NC(=S)C\C=C\c1ccccc1 Amb25112081 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.252 NC(=S)NCSc1ccccc1 Amb25725067 [0,2,0,0,0,0|2,0,0]=4 6373 B12R1.252 NC(=S)NNCc1ccccc1 Amb2439185 [0,2,0,0,0,0|2,0,0]=4 6374 B12R1.252 NC(=S)\C=N\Nc1ccccc1 Amb25337648 [0,2,0,0,0,0|1,0,0]=3 6375 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [0,2,0,0,0,0|1,0,0]=3 6376 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [0,2,0,0,0,0|2,0,0]=4 6377 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [0,2,0,0,0,0|2,0,0]=4 6378 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [0,2,0,0,0,0|1,0,1]=4 6379 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,2,0,0,0,0|1,0,1]=4 6381 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|1,0,1]=4 6382 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [0,2,0,0,0,0|1,0,1]=4 6383 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|0,0,1]=3 6384 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [0,2,0,0,0,0|1,0,1]=4 6385 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|1,0,1]=4 6386 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|1,0,1]=4 6387 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [0,2,0,0,0,0|2,0,0]=4 6388 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [0,2,0,0,0,0|2,0,0]=4 6389 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.252 OC(=O)CONc1cccc[n]1 Amb24497875 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|1,0,1]=4 6394 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [0,2,0,0,0,0|1,0,1]=4 6395 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [0,2,0,0,0,0|0,0,1]=3 6396 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [0,2,0,0,0,0|1,0,1]=4 6397 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [0,2,0,0,0,0|1,0,1]=4 6398 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [0,2,0,0,0,0|1,0,0]=3 6400 B12R1.252 OC(=O)\C=N\Nc1cccc[n]1 Amb24100362 [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [0,2,0,0,0,0|1,0,0]=3 6402 B12R1.252 [O-]C(=O)/C=C/Sc1ccccc1 Amb17913132 [0,2,0,0,0,0|1,0,1]=4 6403 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|1,0,1]=4 6404 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|0,0,2]=4 6405 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,2,0,0,0,0|1,0,1]=4 6406 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.43 C=C(Cl)C(=O)Nc1cccc[n]1 Amb25244198 [0,2,0,0,0,0|1,0,1]=4 6409 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,2,0,0,0,0|1,0,1]=4 6410 B12R1.43 C=C(F)C(=O)Oc1ccccc1 Amb25174018 [0,2,0,0,0,0|1,0,1]=4 6411 B12R1.43 CC(=C)C(=O)Nc1ccc[n]c1 Amb25320521 [0,2,0,0,0,0|1,0,1]=4 6412 B12R1.43 CC(=C)C(=O)Nc1cccc[n]1 Amb25035026 [0,2,0,0,0,0|1,0,1]=4 6413 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,2,0,0,0,0|1,0,0]=3 6414 B12R1.43 CC(=C)C(N)Cc1cc[n]cc1 Amb25779646 [0,2,0,0,0,0|2,0,0]=4 6415 B12R1.43 CC(=C)C(N)Cc1cccc[n]1 Amb24438082 [0,2,0,0,0,0|2,0,0]=4 6416 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,2,0,0,0,0|1,0,1]=4 6418 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,2,0,0,0,0|1,0,1]=4 6419 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,2,0,0,0,0|1,0,1]=4 6420 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,2,0,0,0,0|1,0,1]=4 6421 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,2,0,0,0,0|1,0,1]=4 6422 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,2,0,0,0,0|1,0,1]=4 6423 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,2,0,0,0,0|1,0,1]=4 6424 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,2,0,0,0,0|1,0,1]=4 6425 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,2,0,0,0,0|1,0,1]=4 6426 B12R1.43 CC(C(=O)Cl)Sc1ccccc1 Amb17143250 [0,2,0,0,0,0|2,0,0]=4 6427 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,2,0,0,0,0|1,0,0]=3 6429 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.43 CC(C(=S)N)Oc1ccccc1 Amb17233851 [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 Amb25375808 [0,2,0,0,0,0|0,0,2]=4 6432 B12R1.43 CC(Nc1ccc[n]c1)C(O)=O Amb18270393 [0,2,0,0,0,0|2,0,0]=4 6433 B12R1.43 CC(Nc1ccccc1)C(C)N Amb18646160 [0,2,0,0,0,0|0,0,2]=4 6434 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.43 CC(Oc1ccccc1)C(N)=N Amb18798297 [0,2,0,0,0,0|2,0,0]=4 6436 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,2,0,0,0,0|1,1,0]=4 6437 B12R1.43 CC(Sc1ccccc1)C(N)=N Amb18805146 [0,2,0,0,0,0|2,0,0]=4 6438 B12R1.43 CN(Nc1ccccc1)C(N)=N Amb24557748 [0,2,0,0,0,0|2,0,0]=4 6439 B12R1.43 CN(Nc1ccccc1)C(N)=S Amb24440854 [0,2,0,0,0,0|2,0,0]=4 6440 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,2,0,0,0,0|2,0,0]=4 6441 B12R1.43 C[C@@H](C(=O)O)Nc1ccncc1 Amb10604191 [0,2,0,0,0,0|2,0,0]=4 6442 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,2,0,0,0,0|2,0,0]=4 6443 B12R1.43 C[C@@H](Nc1cccc[n]1)C(O)=O Amb24475793 [0,2,0,0,0,0|2,0,0]=4 6444 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,2,0,0,0,0|1,0,0]=3 6445 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)N Amb25237533 [0,2,0,0,0,0|0,0,2]=4 6446 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [0,2,0,0,0,0|0,0,2]=4 6447 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,2,0,0,0,0|2,0,0]=4 6448 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,2,0,0,0,0|2,0,0]=4 6449 B12R1.43 C[C@H](Nc1ccc[n]c1)C(O)=O Amb25320831 [0,2,0,0,0,0|2,0,0]=4 6450 B12R1.43 C[C@H](Nc1cccc[n]1)C(O)=O Amb24066967 [0,2,0,0,0,0|2,0,0]=4 6451 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,2,0,0,0,0|1,0,0]=3 6452 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,2,0,0,0,0|2,0,0]=4 6453 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,2,0,0,0,0|1,0,1]=4 6455 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,2,0,0,0,0|1,0,1]=4 6459 B12R1.43 NC(=O)C(=N)Nc1ccccc1 Amb24106231 [0,2,0,0,0,0|1,0,1]=4 6460 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,2,0,0,0,0|2,0,0]=4 6461 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,2,0,0,0,0|2,0,0]=4 6463 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,2,0,0,0,0|2,0,0]=4 6464 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,2,0,0,0,0|2,0,0]=4 6465 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,2,0,0,0,0|2,0,0]=4 6466 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,2,0,0,0,0|2,0,0]=4 6467 B12R1.43 NC(=S)C(=S)Nc1ccccc1 Amb22484116 [0,2,0,0,0,0|1,0,1]=4 6468 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,2,0,0,0,0|1,0,1]=4 6471 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,2,0,0,0,0|2,0,0]=4 6474 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.43 NC(Nc1ccccc1)C(=O)Cl Amb24558423 [0,2,0,0,0,0|1,0,0]=3 6477 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,2,0,0,0,0|2,0,0]=4 6479 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,2,0,0,0,0|2,0,0]=4 6483 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,2,0,0,0,0|2,0,0]=4 6486 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,2,0,0,0,0|0,0,2]=4 6487 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,2,0,0,0,0|1,0,1]=4 6488 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,2,0,0,0,0|2,0,0]=4 6489 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,2,0,0,0,0|1,0,1]=4 6490 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,2,0,0,0,0|2,0,0]=4 6491 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,2,0,0,0,0|2,0,0]=4 6492 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,2,0,0,0,0|2,0,0]=4 6494 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|2,0,0]=4 6497 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|2,0,0]=4 6498 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,2,0,0,0,0|2,0,0]=4 6501 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,2,0,0,0,0|2,0,0]=4 6502 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,2,0,0,0,0|1,0,1]=4 6503 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.118 C=CC(CO)Nc1c[n]cc[n]1 Amb24556644 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.118 C=CC(CO)Nc1cc[n]cc1 Amb24343558 [0,2,0,0,0,0|1,0,0]=3 6506 B12R1.118 C=C[C@@H](CO)Nc1ccccc1 Amb25763187 [0,2,0,0,0,0|0,0,0]=2 6507 B12R1.118 C=C\C(\C=O)=C\c1ccccc1 Amb24553053 [0,2,0,0,0,0|1,0,1]=4 6508 B12R1.118 CCC(C#C)Nc1ccccc1 Amb25689867 [0,2,0,0,0,0|0,0,2]=4 6509 B12R1.118 CCC(C#N)Nc1ccccc1 Amb18289853 [0,2,0,0,0,0|0,0,2]=4 6510 B12R1.118 CCC(Nc1ccccc1)CO Amb13952611 [0,2,0,0,0,0|0,0,2]=4 6511 B12R1.118 CO[SiH](Cc1ccccc1)C=C Amb22231750 [0,2,0,0,0,0|1,1,0]=4 6512 B12R1.118 C\C=C(/C#N)\Nc1ccccc1 Amb24682777 [0,2,0,0,0,0|0,0,2]=4 6513 B12R1.118 C\C=C(/C=C)\Oc1ccccc1 Amb24068923 [0,2,0,0,0,0|1,0,1]=4 6514 B12R1.118 N#CC(C=O)Sc1ccccc1 Amb24422403 [0,2,0,0,0,0|2,0,0]=4 6515 B12R1.118 N#CC(CCl)Nc1ccccc1 Amb25151143 [0,2,0,0,0,0|1,0,1]=4 6516 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [0,2,0,0,0,0|2,0,0]=4 6517 B12R1.118 NCC(CO)Nc1ccccc1 Amb25776544 [0,2,0,0,0,0|1,0,1]=4 6518 B12R1.118 OCC(CO)Nc1ccccc1 Amb25060728 [0,2,0,0,0,0|1,0,1]=4 6519 B12R1.194 C=CS(=O)(=O)Cc1ccccc1 Amb2459233 [0,2,0,0,0,0|2,0,0]=4 6520 B12R1.194 C=CS(=O)(=O)Nc1ccccc1 Amb25687468 [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.194 C=CS(=O)(=O)Oc1ccccc1 Amb1153807 [0,2,0,0,0,0|2,0,0]=4 6522 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,2,0,0,0,0|2,0,0]=4 6523 B12R1.194 CC(C)(CO)Nc1ccccc1 Amb18269010 [0,2,0,0,0,0|1,0,1]=4 6524 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [0,2,0,0,0,0|2,0,0]=4 6525 B12R1.194 C[Si](C)(Cc1ccccc1)C=C Amb22733718 [0,2,0,0,0,0|1,1,0]=4 6526 B12R1.194 N#CC(Nc1ccccc1)(C)C Amb2496330 [0,2,0,0,0,0|1,0,1]=4 6527 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [0,2,0,0,0,0|2,0,0]=4 6528 B12R1.194 O=CC(Sc1ccccc1)(C)C Amb2412521 [0,2,0,0,0,0|2,0,0]=4 6529 B12R1.891 CC(C)(C)CNc1ccccc1 Amb22394914 [0,2,0,0,0,0|0,0,2]=4 6530 B12R1.891 CC(C)(N)CNc1ccccc1 Amb18974263 [0,2,0,0,0,0|0,0,2]=4 6531 B12R1.891 CC(C)(S)CNc1ccccc1 Amb25764000 [0,2,0,0,0,0|0,0,2]=4 6532 B12R1.891 CC(CNc1ccccc1)(C)C Amb10889788 [0,2,0,0,0,0|0,0,2]=4 6533 B12R1.891 CC(CNc1ccccc1)(O)C Amb17138596 [0,2,0,0,0,0|0,0,2]=4 6534 B12R1.891 CC(F)(F)CNc1ccccc1 Amb25323931 [0,2,0,0,0,0|0,0,2]=4 6535 B12R1.891 C[Si](C)(C)CNc1ccccc1 Amb24423870 [0,2,0,0,0,0|0,1,1]=4 6536 B12R1.891 FC(F)(Br)CNc1ccccc1 Amb25837719 [0,2,0,0,0,0|1,0,1]=4 6537 B12R1.891 F[B-](F)(F)CNc1ccccc1 Amb25683480 [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.891 [O-]S(=O)(=O)CNc1ccccc1 Amb22359475 [0,2,0,0,0,0|2,0,0]=4 6539 B10R1.187 C=CCN1C(=O)C=CC1=O Amb2581408 [0,0,1,1,0,0|2,0,0]=4 6540 B10R1.5 C=CC[n]1[n]ccc1C=O Amb24598055 [0,0,1,1,0,0|2,0,0]=4 6541 B10R1.5 C=CC[n]1cccc1C#N Amb22971210 [0,0,1,1,0,0|1,0,1]=4 6542 B10R1.5 C=CC[n]1cccc1CO Amb24457923 [0,0,1,1,0,0|1,0,1]=4 6543 B10R1.5 C=Cc1c[n]c[n]1CC=C Amb25792688 [0,0,1,1,0,0|1,0,0]=3 6544 B10R1.5 C=Cc1ccc[n]1CC=C Amb25807993 [0,0,1,1,0,0|0,0,0]=2 6545 B10R1.20 C=Cc1[n]cccc1C=C Amb24101634 [0,0,1,1,0,0|0,0,2]=4 6546 B10R1.20 C=Cc1ccccc1C=C Amb17689476 [0,0,1,1,0,0|1,0,1]=4 6547 B10R1.172 C=Cc1cc(ccc1)C=C Amb22045893 [0,0,1,1,0,0|1,0,1]=4 6548 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|1,0,1]=4 6549 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|1,0,1]=4 6550 B10R2.6 C=1NC1c2ccccc2 Amb25848069 [1,0,0,1,0,0|1,0,1]=4 6551 B10R2.6 c1[n]cccc1N2C=N2 Amb24085124 [1,0,0,1,0,0|2,0,0]=4 6552 B10R2.7 C1C=C2C=NC=CC2=C1 Amb25032263 [1,0,0,1,0,0|2,0,0]=4 6553 B10R2.7 C1C=C2N=CC=CC2=N1 Amb25377928 [1,0,0,1,0,0|1,0,1]=4 6554 B10R2.7 C1C=Cc2[n]c[n]cc21 Amb24090168 [1,0,0,1,0,0|2,0,0]=4 6555 B10R2.7 C1C=Cc2[n]cccc21 Amb22496284 [1,0,0,1,0,0|1,0,0]=3 6556 B10R2.7 C1C=Cc2cc[nH]c2N1 Amb25064634 [1,0,0,1,0,0|1,0,1]=4 6557 B10R2.7 C1C=Cc2ccc[n]c21 Amb21963524 [1,0,0,1,0,0|1,0,0]=3 6558 B10R2.7 C1C=Nc2[n]cccc21 Amb21927360 [1,0,0,1,0,0|2,0,0]=4 6559 B10R2.7 C1C=Nc2ccc[n]c21 Amb24099986 [1,0,0,1,0,0|2,0,0]=4 6560 B10R2.7 C1CNc2c[n]ccc21 Amb19516033 [1,0,0,1,0,0|1,0,1]=4 6561 B10R2.7 C1CNc2c[n]ccc21 Amb22495003 [1,0,0,1,0,0|1,0,1]=4 6562 B10R2.7 C1CNc2c[n]ccc21 Amb23412122 [1,0,0,1,0,0|1,0,1]=4 6563 B10R2.7 C1CNc2cc[n]cc21 Amb19515489 [1,0,0,1,0,0|1,0,1]=4 6564 B10R2.7 C1CNc2cc[n]cc21 Amb22372217 [1,0,0,1,0,0|1,0,1]=4 6565 B10R2.7 C1CNc2ccc[n]c21 Amb18833005 [1,0,0,1,0,0|1,0,1]=4 6566 B10R2.7 C1CNc2ccc[n]c21 Amb22494916 [1,0,0,1,0,0|1,0,1]=4 6567 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|0,1,1]=4 6568 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|1,0,1]=4 6569 B10R2.7 C1N=Cc2cc[n]cc21 Amb25032262 [1,0,0,1,0,0|2,0,0]=4 6570 B10R2.7 C1N=Cc2ccc[n]c21 Amb25798436 [1,0,0,1,0,0|2,0,0]=4 6571 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|1,0,0]=3 6572 B10R2.7 C1N=c2ccccc2=N1 Amb24100741 [1,0,0,1,0,0|1,0,1]=4 6573 B10R2.7 C1NC=C2C=CCC=C21 Amb24684921 [1,0,0,1,0,0|1,0,1]=4 6574 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|1,0,1]=4 6575 B10R2.7 C1Nc2ccccc2P1 Amb25102824 [1,0,0,1,0,0|1,0,0]=3 6576 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|2,0,0]=4 6577 B10R2.7 C1Oc2ccccc2S1 Amb21963815 [1,0,0,1,0,0|2,0,0]=4 6578 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|1,0,1]=4 6579 B10R2.7 c1[nH]c2[n]cccc2[n]1 Amb22756777 [1,0,0,1,0,0|2,0,0]=4 6580 B10R2.7 c1[nH]c2ccccc2[p]1 Amb24340147 [1,0,0,1,0,0|1,0,0]=3 6581 B10R2.7 c1[nH]ccc2[n]ccc21 Amb25785260 [1,0,0,1,0,0|1,0,1]=4 6582 B10R2.7 c1[nH]ccc2cccc21 Amb25147132 [1,0,0,1,0,0|1,0,1]=4 6583 B10R2.7 c1[n][n]cc2[nH]ccc21 Amb22235950 [1,0,0,1,0,0|2,0,0]=4 6584 B10R2.7 c1[n]c2ccccc2[se]1 Amb22346204 [1,0,0,1,0,0|1,0,1]=4 6585 B10R2.7 c1[n]ccc2[s]ccc21 Amb24066976 [1,0,0,1,0,0|2,0,0]=4 6586 B10R2.7 c1[n]ccc2cc[nH]c21 Amb22753659 [1,0,0,1,0,0|1,0,0]=3 6587 B10R2.7 c1[n]ccc2cc[s]c21 Amb24066968 [1,0,0,1,0,0|2,0,0]=4 6588 B10R2.7 c1[n]ccc2occc21 Amb19895064 [1,0,0,1,0,0|2,0,0]=4 6589 B10R2.7 c1[s][n]c2ccccc21 Amb25336989 [1,0,0,1,0,0|1,0,1]=4 6590 B10R2.7 c1[s]cc2ccccc21 Amb24066379 [1,0,0,1,0,0|1,0,1]=4 6591 B10R2.7 c1c[n+]2ccccc2[nH]1 Amb24482145 [1,0,0,1,0,0|1,0,0]=3 6592 B10R2.7 c1c[n][n]c2[nH]ccc21 Amb21964556 [1,0,0,1,0,0|2,0,0]=4 6593 B10R2.7 c1cc[n]c2occc21 Amb21963452 [1,0,0,1,0,0|2,0,0]=4 6594 B10R2.7 c1ccc2[n+](c1)CCN2 Amb10552798 [1,0,0,1,0,0|1,0,1]=4 6595 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|0,0,0]=2 6596 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|0,0,1]=3 6597 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205278 [1,0,0,1,0,0|1,0,1]=4 6598 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205847 [1,0,0,1,0,0|1,0,1]=4 6599 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10553250 [1,0,0,1,0,0|2,0,0]=4 6600 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10566511 [1,0,0,1,0,0|2,0,0]=4 6601 B10R2.7 c1ccc2c(c1)[nH+]n[nH]2 Amb10575340 [1,0,0,1,0,0|2,0,0]=4 6602 B10R2.7 c1ccc2c(c1)[nH]nc2 Amb1323321 [1,0,0,1,0,0|1,0,0]=3 6603 B10R2.7 c1ccc2c(c1)[nH]nn2 Amb10553984 [1,0,0,1,0,0|2,0,0]=4 6604 B10R2.7 c1ccc2c(c1)[nH]nn2 Amb1158937 [1,0,0,1,0,0|2,0,0]=4 6605 B10R2.7 c1ccc2c(c1)onc2 Amb1233398 [1,0,0,1,0,0|2,0,0]=4 6606 B10R2.7 c1ccc2n(c1)ccc2 Amb10605601 [1,0,0,1,0,0|1,0,1]=4 6607 B10R2.7 c1ccc2n(c1)ccn2 Amb2235938 [1,0,0,1,0,0|1,0,1]=4 6608 B10R2.7 c1ccc2n(c1)ncc2 Amb10604230 [1,0,0,1,0,0|1,0,1]=4 6609 B10R2.7 c1cccc2NSNc21 Amb24103819 [1,0,0,1,0,0|2,0,0]=4 6610 B10R2.7 c1cnc2c(c1)[nH]nc2 Amb16185746 [1,0,0,1,0,0|2,0,0]=4 6611 B10R2.7 c1cnc2c(c1)ccs2 Amb10070403 [1,0,0,1,0,0|2,0,0]=4 6612 B10R2.7 c1cnc2c(c1)nc[nH]2 Amb2423657 [1,0,0,1,0,0|2,0,0]=4 6613 B10R2.7 c1cnc2c(c1)occ2 Amb16185654 [1,0,0,1,0,0|2,0,0]=4 6614 B10R2.7 c1cnc2c(c1)scc2 Amb10070404 [1,0,0,1,0,0|2,0,0]=4 6615 B10R2.7 c1cnc2c(n1)[nH]cc2 Amb10602400 [1,0,0,1,0,0|2,0,0]=4 6616 B10R2.7 c1ncc2c(c1)[nH]cn2 Amb13891875 [1,0,0,1,0,0|2,0,0]=4 6617 B10R2.7 c1ncc2c(c1)[nH]nc2 Amb16185747 [1,0,0,1,0,0|2,0,0]=4 6618 B10R2.7 c1ncc2c(c1)cco2 Amb10067356 [1,0,0,1,0,0|2,0,0]=4 6619 B10R2.7 c1ncc2c(c1)ccs2 Amb10067355 [1,0,0,1,0,0|2,0,0]=4 6620 B10R2.7 c1ncc2c(n1)[nH]cc2 Amb10603928 [1,0,0,1,0,0|2,0,0]=4 6621 B10R2.7 c1ncc2c(n1)cc[nH]2 Amb10602933 [1,0,0,1,0,0|2,0,0]=4 6622 B10R2.7 c1occ2ccccc21 Amb25709480 [1,0,0,1,0,0|1,0,1]=4 6623 B10R2.7 c:1:c:c:[nH]:c-2:[n]:c:c:c21 Amb22489484 [1,0,0,1,0,0|1,0,1]=4 6624 B10R2.7 c:1:c:c:[nH]:c-2:c:c:c:c21 Amb22490477 [1,0,0,1,0,0|1,0,1]=4 6625 B10R2.320 BrC1=Cc2ccccc21 Amb20248944 [1,0,0,1,0,0|1,0,1]=4 6626 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|0,0,2]=4 6627 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [1,0,0,1,0,0|1,0,1]=4 6628 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,1]=4 6629 B10R2.320 O=C1Cc2[n]cccc21 Amb24061107 [1,0,0,1,0,0|2,0,0]=4 6630 B10R2.320 O=C1Cc2c[n]ccc21 Amb24587705 [1,0,0,1,0,0|2,0,0]=4 6631 B10R2.320 O=C1Cc2ccc[n]c21 Amb24479915 [1,0,0,1,0,0|2,0,0]=4 6632 B10R2.320 O=C1Nc2[n]cccc21 Amb24061210 [1,0,0,1,0,0|2,0,0]=4 6633 B10R2.320 O=C1Nc2c[n]ccc21 Amb24635548 [1,0,0,1,0,0|2,0,0]=4 6634 B10R2.320 OC1=Cc2ccccc21 Amb22002555 [1,0,0,1,0,0|1,0,1]=4 6635 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|1,0,1]=4 6636 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|1,0,1]=4 6637 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|1,0,1]=4 6638 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|1,0,1]=4 6639 B10R2.32 O=C1CNc2[nH]ccc21 Amb18832992 [0,0,0,1,1,0|2,0,0]=4 6640 B10R2.32 O=C1CNc2[s]ccc21 Amb18202969 [0,0,0,1,1,0|2,0,0]=4 6641 B10R2.32 O=C1CNc2c[nH]cc21 Amb18832989 [0,0,0,1,1,0|2,0,0]=4 6642 B10R2.32 O=C1CNc2c[s]cc21 Amb18202966 [0,0,0,1,1,0|2,0,0]=4 6643 B10R2.32 O=C1CNc2cc[nH]c21 Amb18832991 [0,0,0,1,1,0|2,0,0]=4 6644 B10R2.32 O=C1CNc2cc[s]c21 Amb18202968 [0,0,0,1,1,0|2,0,0]=4 6645 B10R2.32 O=C1CNc2ccoc21 Amb18832975 [0,0,0,1,1,0|2,0,0]=4 6646 B10R2.32 O=C1CNc2cocc21 Amb18832972 [0,0,0,1,1,0|2,0,0]=4 6647 B10R2.32 O=C1CNc2occc21 Amb18832976 [0,0,0,1,1,0|2,0,0]=4 6648 B12R2.41 C1C=Cc2ccccc2C=C1 Amb24425441 [0,0,0,1,0,1|1,0,1]=4 6649 B12R2.41 C1N=C2C=CC=CC=C2C=N1 Amb24100745 [0,0,0,1,0,1|1,0,1]=4 6650 B12R2.41 C=1N=CNC2=CC=CC=NC21 Amb25736260 [0,0,0,1,0,1|1,0,1]=4 6651 B12R2.41 C=1N=CNC2=CC=NC=CC21 Amb25087784 [0,0,0,1,0,1|1,0,1]=4 6652 B12R2.41 C=1NC=CC=C2C=CC=CC21 Amb24351660 [0,0,0,1,0,1|1,0,1]=4 6653 B12R2.41 c1[n]ccc2OC=CC=Cc21 Amb25148311 [0,0,0,1,0,1|2,0,0]=4 6654 B12R2.41 c1c[n]2cccccc2[nH]o1 Amb24078398 [0,0,0,1,0,1|1,0,0]=3 6655 B12R2.41 c1cc[n]c2C=COC=Cc21 Amb25067030 [0,0,0,1,0,1|0,0,2]=4 6656 B12R2.41 c1cccc2NC=CC=Cc21 Amb25340361 [0,0,0,1,0,1|1,0,1]=4 6657 B12R2.586 O=C1CCC2=CC=CC=CC21 Amb25150334 [0,0,0,1,0,1|2,0,0]=4 6658 B12R2.586 O=C1CCC=2C=CCC=CC21 Amb24357209 [0,0,0,1,0,1|2,0,0]=4 6659 B12R2.586 O=C1CCC=2CC=CC=CC21 Amb24097416 [0,0,0,1,0,1|2,0,0]=4 6660 B12R2.586 O=C1COC=2CC=CC=CC21 Amb25151516 [0,0,0,1,0,1|2,0,0]=4 6661 B12R2.2017 C1=CC2=CC=CC=C(C=C1)C2 Amb17778329 [0,0,0,1,0,1|1,0,1]=4 6662 B12R2.2017 c1ccc2ccccc(c1)[cH+]2 Amb17778312 [0,0,0,1,0,1|1,0,1]=4 6663 B12R2.2017 c:1:c:c:c:c2:c:c:c:c:c1N2 Amb24459831 [0,0,0,1,0,1|1,0,1]=4 6664 B12R2.2017 c:1:c:c:c:c2:c:c:c:c:c1O2 Amb22227832 [0,0,0,1,0,1|1,0,1]=4 6665 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [0,1,0,1,0,0|1,0,0]=3 6666 B12R2.24 BrC=1CNc2ccccc2C1 Amb24381392 [0,1,0,1,0,0|0,0,0]=2 6667 B12R2.24 Brc1cc2COCNc2cc1 Amb24564128 [0,1,0,1,0,0|1,0,1]=4 6668 B12R2.24 Brc1cc2NCCNc2cc1 Amb22231980 [0,1,0,1,0,0|1,0,1]=4 6669 B12R2.24 Brc1cc2NCCOc2cc1 Amb21964574 [0,1,0,1,0,0|1,0,1]=4 6670 B12R2.24 Brc1cc2NCCSc2cc1 Amb24487014 [0,1,0,1,0,0|1,0,1]=4 6671 B12R2.24 Brc1cc2OCCNc2cc1 Amb19958005 [0,1,0,1,0,0|1,0,1]=4 6672 B12R2.24 Brc1cc2SCCNc2cc1 Amb25086833 [0,1,0,1,0,0|1,0,1]=4 6673 B12R2.24 Brc1cc2[n][n]ccc2cc1 Amb22276042 [0,1,0,1,0,0|1,0,1]=4 6674 B12R2.24 Brc1cc2c[n]ccc2cc1 Amb22276934 [0,1,0,1,0,0|2,0,0]=4 6675 B12R2.24 Brc1cc2cc[n][n]c2cc1 Amb20241324 [0,1,0,1,0,0|1,0,1]=4 6676 B12R2.24 Brc1cc2cc[n]cc2cc1 Amb24183290 [0,1,0,1,0,0|2,0,0]=4 6677 B12R2.24 Brc1cc2ccc[n]c2cc1 Amb19516224 [0,1,0,1,0,0|0,0,2]=4 6678 B12R2.24 Brc1cc2ccc[n]c2cc1 Amb22233550 [0,1,0,1,0,0|0,0,2]=4 6679 B12R2.24 Brc1ccc2CCN=Cc2c1 Amb22490212 [0,1,0,1,0,0|2,0,0]=4 6680 B12R2.24 Brc1ccc2OCC=Cc2c1 Amb22231978 [0,1,0,1,0,0|1,0,0]=3 6681 B12R2.24 Brc1ccc2c(c1)C=CCC2 Amb2383772 [0,1,0,1,0,0|1,0,0]=3 6682 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb1090469 [0,1,0,1,0,0|0,0,2]=4 6683 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb10576260 [0,1,0,1,0,0|0,0,2]=4 6684 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb2383341 [0,1,0,1,0,0|0,0,2]=4 6685 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [0,1,0,1,0,0|1,0,1]=4 6686 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [0,1,0,1,0,0|1,0,1]=4 6687 B12R2.24 Brc1ccc2c(c1)cccc2 Amb1159157 [0,1,0,1,0,0|1,0,1]=4 6688 B12R2.24 Brc1ccc2c(c1)cccn2 Amb1033034 [0,1,0,1,0,0|0,0,2]=4 6689 B12R2.24 Brc1nnc2c(c1)cccc2 Amb10602274 [0,1,0,1,0,0|1,0,1]=4 6690 B12R2.24 C=C1C=C2C=CC=CC2=CN1 Amb25268639 [0,1,0,1,0,0|2,0,0]=4 6691 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,1,0,1,0,0|1,0,0]=3 6692 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,1,0,1,0,0|1,0,0]=3 6693 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [0,1,0,1,0,0|1,0,1]=4 6694 B12R2.24 CC1=Nc2c(SC1)cccc2 Amb10976510 [0,1,0,1,0,0|1,0,1]=4 6695 B12R2.24 CC1C=Cc2[n]cccc2O1 Amb25700391 [0,1,0,1,0,0|2,0,0]=4 6696 B12R2.24 CC1C=Cc2c(N1)cccc2 Amb17593644 [0,1,0,1,0,0|0,0,0]=2 6697 B12R2.24 CC1C=Cc2ccccc2O1 Amb24715788 [0,1,0,1,0,0|1,0,0]=3 6698 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [0,1,0,1,0,0|0,0,2]=4 6699 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [0,1,0,1,0,0|0,0,2]=4 6700 B12R2.24 CC1CNc2c(O1)cccc2 Amb17097653 [0,1,0,1,0,0|0,0,2]=4 6701 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,1,0,1,0,0|1,0,1]=4 6702 B12R2.24 CC1Cc2ccccc2N=C1 Amb24682970 [0,1,0,1,0,0|2,0,0]=4 6703 B12R2.24 CC1Cc2ccccc2NC1 Amb22501042 [0,1,0,1,0,0|0,0,2]=4 6704 B12R2.24 CC1Nc2ccccc2CS1 Amb24373918 [0,1,0,1,0,0|1,0,1]=4 6705 B12R2.24 CC1Nc2ccccc2N=N1 Amb24671082 [0,1,0,1,0,0|2,0,0]=4 6706 B12R2.24 CC=1CNc2ccccc2C1 Amb18559652 [0,1,0,1,0,0|0,0,0]=2 6707 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [0,1,0,1,0,0|1,0,0]=3 6708 B12R2.24 CC=1CSc2ccccc2C1 Amb24485796 [0,1,0,1,0,0|1,0,0]=3 6709 B12R2.24 CN1C=Nc2ccccc2N1 Amb24623403 [0,1,0,1,0,0|2,0,0]=4 6710 B12R2.24 CP1CNc2ccccc2S1 Amb25351765 [0,1,0,1,0,0|1,0,1]=4 6711 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [0,1,0,1,0,0|0,0,2]=4 6712 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb22747779 [0,1,0,1,0,0|2,0,0]=4 6713 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [0,1,0,1,0,0|0,0,2]=4 6714 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,1,0,1,0,0|0,0,2]=4 6715 B12R2.24 C[C@H]1Cc2ccccc2C=N1 Amb25056784 [0,1,0,1,0,0|2,0,0]=4 6716 B12R2.24 C[N+]1=Cc2c(CC1)cccc2 Amb10553962 [0,1,0,1,0,0|2,0,0]=4 6717 B12R2.24 C[n+]1ccc2c(c1)cccc2 Amb1147460 [0,1,0,1,0,0|2,0,0]=4 6718 B12R2.24 Cc1cc2CCC=Cc2[n]c1 Amb24081298 [0,1,0,1,0,0|2,0,0]=4 6719 B12R2.24 Cc1cc2CCCNc2cc1 Amb22499776 [0,1,0,1,0,0|0,0,2]=4 6720 B12R2.24 Cc1cc2NCC=Cc2cc1 Amb18062194 [0,1,0,1,0,0|0,0,0]=2 6721 B12R2.24 Cc1cc2NCCNc2cc1 Amb20080170 [0,1,0,1,0,0|1,0,1]=4 6722 B12R2.24 Cc1cc2NCCOc2cc1 Amb22234866 [0,1,0,1,0,0|1,0,1]=4 6723 B12R2.24 Cc1cc2NCCSc2cc1 Amb22886453 [0,1,0,1,0,0|1,0,1]=4 6724 B12R2.24 Cc1cc2SCCNc2cc1 Amb22498966 [0,1,0,1,0,0|1,0,1]=4 6725 B12R2.24 Cc1cc2c[n]ccc2cc1 Amb18349166 [0,1,0,1,0,0|2,0,0]=4 6726 B12R2.24 Cc1cc2cc[n][n]c2cc1 Amb21858505 [0,1,0,1,0,0|1,0,1]=4 6727 B12R2.24 Cc1cc2ccc[n]c2cc1 Amb22235973 [0,1,0,1,0,0|0,0,2]=4 6728 B12R2.24 Cc1cc2ccccc2[n][n]1 Amb24062163 [0,1,0,1,0,0|1,0,1]=4 6729 B12R2.24 Cc1ccc2CCCNc2c1 Amb22000879 [0,1,0,1,0,0|0,0,2]=4 6730 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500760 [0,1,0,1,0,0|2,0,0]=4 6731 B12R2.24 Cc1ccc2CCN=Cc2c1 Amb22500763 [0,1,0,1,0,0|2,0,0]=4 6732 B12R2.24 Cc1ccc2NCC=Cc2c1 Amb18062199 [0,1,0,1,0,0|0,0,0]=2 6733 B12R2.24 Cc1ccc2OCC=Cc2c1 Amb23441455 [0,1,0,1,0,0|1,0,0]=3 6734 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb1089737 [0,1,0,1,0,0|0,0,2]=4 6735 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb2099820 [0,1,0,1,0,0|0,0,2]=4 6736 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [0,1,0,1,0,0|1,0,1]=4 6737 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [0,1,0,1,0,0|1,0,1]=4 6738 B12R2.24 Cc1ccc2c(c1)cccn2 Amb10553829 [0,1,0,1,0,0|0,0,2]=4 6739 B12R2.24 Cc1ccc2c(c1)ccnc2 Amb10071945 [0,1,0,1,0,0|2,0,0]=4 6740 B12R2.24 Cc1ccc2c(n1)cccc2 Amb1151967 [0,1,0,1,0,0|0,0,2]=4 6741 B12R2.24 Cc1ccc2ccccc2[n]1 Amb24097096 [0,1,0,1,0,0|0,0,2]=4 6742 B12R2.24 Cc1cnc2c(c1)cccc2 Amb2447051 [0,1,0,1,0,0|0,0,2]=4 6743 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [0,1,0,1,0,0|0,0,2]=4 6744 B12R2.24 ClC=1COc2ccccc2N1 Amb18118341 [0,1,0,1,0,0|2,0,0]=4 6745 B12R2.24 Clc1cc2CCN=Cc2cc1 Amb24649802 [0,1,0,1,0,0|2,0,0]=4 6746 B12R2.24 Clc1cc2COCNc2cc1 Amb25211398 [0,1,0,1,0,0|1,0,1]=4 6747 B12R2.24 Clc1cc2N=CCNc2cc1 Amb25783840 [0,1,0,1,0,0|1,0,0]=3 6748 B12R2.24 Clc1cc2NCC=Cc2cc1 Amb18062146 [0,1,0,1,0,0|0,0,0]=2 6749 B12R2.24 Clc1cc2NCCOc2cc1 Amb22490751 [0,1,0,1,0,0|1,0,1]=4 6750 B12R2.24 Clc1cc2OCC=Cc2cc1 Amb24349799 [0,1,0,1,0,0|1,0,0]=3 6751 B12R2.24 Clc1cc2SCCNc2cc1 Amb25151172 [0,1,0,1,0,0|1,0,1]=4 6752 B12R2.24 Clc1cc2[n][n]ccc2cc1 Amb22752658 [0,1,0,1,0,0|1,0,1]=4 6753 B12R2.24 Clc1cc2cc[n][n]c2cc1 Amb22233949 [0,1,0,1,0,0|1,0,1]=4 6754 B12R2.24 Clc1cc2ccc[n]c2cc1 Amb22234257 [0,1,0,1,0,0|0,0,2]=4 6755 B12R2.24 Clc1cc2ccccc2[n][n]1 Amb22523503 [0,1,0,1,0,0|1,0,1]=4 6756 B12R2.24 Clc1cc2ccccc2[n]c1 Amb19515997 [0,1,0,1,0,0|0,0,2]=4 6757 B12R2.24 Clc1ccc2CCC=Cc2[n]1 Amb25257377 [0,1,0,1,0,0|2,0,0]=4 6758 B12R2.24 Clc1ccc2NCC=Cc2c1 Amb18062201 [0,1,0,1,0,0|0,0,0]=2 6759 B12R2.24 Clc1ccc2OCC=Cc2c1 Amb22586260 [0,1,0,1,0,0|1,0,0]=3 6760 B12R2.24 Clc1ccc2c(c1)C=CCC2 Amb2383770 [0,1,0,1,0,0|1,0,0]=3 6761 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb1133229 [0,1,0,1,0,0|0,0,2]=4 6762 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb10576261 [0,1,0,1,0,0|0,0,2]=4 6763 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb2383339 [0,1,0,1,0,0|0,0,2]=4 6764 B12R2.24 Clc1ccc2c(c1)NCCN2 Amb10605577 [0,1,0,1,0,0|1,0,1]=4 6765 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [0,1,0,1,0,0|1,0,1]=4 6766 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb2371893 [0,1,0,1,0,0|1,0,1]=4 6767 B12R2.24 Clc1ccc2c(c1)OCC=N2 Amb10603916 [0,1,0,1,0,0|2,0,0]=4 6768 B12R2.24 Clc1ccc2c(c1)ccnc2 Amb10603859 [0,1,0,1,0,0|2,0,0]=4 6769 B12R2.24 Clc1ccc2c(c1)nccc2 Amb10069239 [0,1,0,1,0,0|0,0,2]=4 6770 B12R2.24 Clc1ncc2c(c1)cccc2 Amb10071462 [0,1,0,1,0,0|2,0,0]=4 6771 B12R2.24 FC1CNc2ccccc2O1 Amb25301702 [0,1,0,1,0,0|1,0,1]=4 6772 B12R2.24 FC1Cc2ccccc2NC1 Amb25207965 [0,1,0,1,0,0|0,0,2]=4 6773 B12R2.24 FC=1CNc2ccccc2C1 Amb25063014 [0,1,0,1,0,0|0,0,0]=2 6774 B12R2.24 Fc1cc2CCC=Cc2cc1 Amb25320782 [0,1,0,1,0,0|1,0,0]=3 6775 B12R2.24 Fc1cc2CCN=Cc2cc1 Amb24091693 [0,1,0,1,0,0|2,0,0]=4 6776 B12R2.24 Fc1cc2NCCSc2cc1 Amb25713881 [0,1,0,1,0,0|1,0,1]=4 6777 B12R2.24 Fc1cc2OCC=Cc2cc1 Amb24485991 [0,1,0,1,0,0|1,0,0]=3 6778 B12R2.24 Fc1cc2[n][n]ccc2cc1 Amb24092090 [0,1,0,1,0,0|1,0,1]=4 6779 B12R2.24 Fc1cc2c[n]ccc2cc1 Amb19100617 [0,1,0,1,0,0|2,0,0]=4 6780 B12R2.24 Fc1cc2cc[n][n]c2cc1 Amb22233954 [0,1,0,1,0,0|1,0,1]=4 6781 B12R2.24 Fc1cc2cc[n]cc2cc1 Amb19958275 [0,1,0,1,0,0|2,0,0]=4 6782 B12R2.24 Fc1cc2ccc[n]c2cc1 Amb22831215 [0,1,0,1,0,0|0,0,2]=4 6783 B12R2.24 Fc1cc2ccccc2[n]c1 Amb22234447 [0,1,0,1,0,0|0,0,2]=4 6784 B12R2.24 Fc1cc2ccccc2c[n]1 Amb20621378 [0,1,0,1,0,0|2,0,0]=4 6785 B12R2.24 Fc1ccc2CCCNc2c1 Amb22586301 [0,1,0,1,0,0|0,0,2]=4 6786 B12R2.24 Fc1ccc2CCN=Cc2c1 Amb24092083 [0,1,0,1,0,0|2,0,0]=4 6787 B12R2.24 Fc1ccc2NCC=Cc2c1 Amb18062200 [0,1,0,1,0,0|0,0,0]=2 6788 B12R2.24 Fc1ccc2OCC=Cc2c1 Amb25770785 [0,1,0,1,0,0|1,0,0]=3 6789 B12R2.24 Fc1ccc2c(c1)C=CCC2 Amb2383771 [0,1,0,1,0,0|1,0,0]=3 6790 B12R2.24 Fc1ccc2c(c1)CCCN2 Amb1107937 [0,1,0,1,0,0|0,0,2]=4 6791 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb2383340 [0,1,0,1,0,0|0,0,2]=4 6792 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [0,1,0,1,0,0|1,0,1]=4 6793 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [0,1,0,1,0,0|1,0,1]=4 6794 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [0,1,0,1,0,0|1,0,1]=4 6795 B12R2.24 Fc1ccc2ccccc2[n]1 Amb20171185 [0,1,0,1,0,0|0,0,2]=4 6796 B12R2.24 Ic1cc2NCCOc2cc1 Amb22586266 [0,1,0,1,0,0|1,0,1]=4 6797 B12R2.24 Ic1cc2[n]cccc2cc1 Amb21858708 [0,1,0,1,0,0|0,0,2]=4 6798 B12R2.24 Ic1cc2c[n]ccc2cc1 Amb22170101 [0,1,0,1,0,0|2,0,0]=4 6799 B12R2.24 Ic1cc2cc[n][n]c2cc1 Amb22751176 [0,1,0,1,0,0|1,0,1]=4 6800 B12R2.24 Ic1cc2ccccc2[n]c1 Amb19373724 [0,1,0,1,0,0|0,0,2]=4 6801 B12R2.24 Ic1cc2ccccc2c[n]1 Amb22170100 [0,1,0,1,0,0|2,0,0]=4 6802 B12R2.24 Ic1ccc2CCCNc2c1 Amb22586311 [0,1,0,1,0,0|0,0,2]=4 6803 B12R2.24 Ic1ccc2c(c1)NCCC2 Amb2383346 [0,1,0,1,0,0|0,0,2]=4 6804 B12R2.24 Ic1ccc2c(c1)NCCO2 Amb2383453 [0,1,0,1,0,0|1,0,1]=4 6805 B12R2.24 Ic1ccc2c(c1)cccn2 Amb10066910 [0,1,0,1,0,0|0,0,2]=4 6806 B12R2.24 Ic1ccc2c(c1)ccnc2 Amb10070847 [0,1,0,1,0,0|2,0,0]=4 6807 B12R2.24 Ic1ccc2c(n1)cccc2 Amb10604284 [0,1,0,1,0,0|0,0,2]=4 6808 B12R2.24 N=C1CN=c2ccccc2=C1 Amb24061571 [0,1,0,1,0,0|0,0,1]=3 6809 B12R2.24 NC1=Nc2c(CC1)cccc2 Amb2373583 [0,1,0,1,0,0|2,0,0]=4 6810 B12R2.24 NC1=Nc2c(SC1)cccc2 Amb19136101 [0,1,0,1,0,0|2,0,0]=4 6811 B12R2.24 NC1=Nc2c(SC1)cccc2 Amb1918677 [0,1,0,1,0,0|2,0,0]=4 6812 B12R2.24 NC1C=Cc2c(C1)cccc2 Amb17470378 [0,1,0,1,0,0|1,0,0]=3 6813 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|1,0,0]=3 6814 B12R2.24 NC1C=Nc2[n]cccc2N1 Amb25132117 [0,1,0,1,0,0|2,0,0]=4 6815 B12R2.24 NC1CNc2ccccc2O1 Amb24417784 [0,1,0,1,0,0|1,0,1]=4 6816 B12R2.24 NC=1CNc2ccccc2C1 Amb25079184 [0,1,0,1,0,0|0,0,0]=2 6817 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [0,1,0,1,0,0|2,0,0]=4 6818 B12R2.24 N[C@H]1Cc2ccccc2C=C1 Amb24699393 [0,1,0,1,0,0|1,0,0]=3 6819 B12R2.24 N[C@H]1Cc2ccccc2NC1 Amb25224756 [0,1,0,1,0,0|0,0,2]=4 6820 B12R2.24 N[n+]1ccc2c(c1)cccc2 Amb10553664 [0,1,0,1,0,0|2,0,0]=4 6821 B12R2.24 N[n+]1ccc2c(c1)cccc2 Amb10553680 [0,1,0,1,0,0|2,0,0]=4 6822 B12R2.24 N[n+]1ccc2c(c1)cccc2 Amb10558624 [0,1,0,1,0,0|2,0,0]=4 6823 B12R2.24 Nc1cc2N=CCOc2cc1 Amb24093681 [0,1,0,1,0,0|2,0,0]=4 6824 B12R2.24 Nc1cc2[n][n]ccc2cc1 Amb21857232 [0,1,0,1,0,0|1,0,1]=4 6825 B12R2.24 Nc1cc2[n]cccc2cc1 Amb24183307 [0,1,0,1,0,0|0,0,2]=4 6826 B12R2.24 Nc1cc2cc[n][n]c2cc1 Amb21857010 [0,1,0,1,0,0|1,0,1]=4 6827 B12R2.24 Nc1cc2ccc[n]c2cc1 Amb22235930 [0,1,0,1,0,0|0,0,2]=4 6828 B12R2.24 Nc1cc2ccccc2[n]c1 Amb22276924 [0,1,0,1,0,0|0,0,2]=4 6829 B12R2.24 Nc1cc2ccccc2cc1 Amb22057457 [0,1,0,1,0,0|1,0,1]=4 6830 B12R2.24 Nc1cc[13c]2[13c](c1)[13cH][13cH][13cH][13cH]2 Amb17618259 [0,1,0,1,0,0|1,0,1]=4 6831 B12R2.24 Nc1ccc2CCCNc2c1 Amb22494228 [0,1,0,1,0,0|0,0,2]=4 6832 B12R2.24 Nc1ccc2CCN=Cc2c1 Amb25145814 [0,1,0,1,0,0|2,0,0]=4 6833 B12R2.24 Nc1ccc2OCC=Cc2c1 Amb23441460 [0,1,0,1,0,0|1,0,0]=3 6834 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb17598307 [0,1,0,1,0,0|0,0,2]=4 6835 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb17598306 [0,1,0,1,0,0|0,0,2]=4 6836 B12R2.24 Nc1ccc2c(c1)NCCN2 Amb10606637 [0,1,0,1,0,0|1,0,1]=4 6837 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [0,1,0,1,0,0|1,0,1]=4 6838 B12R2.24 Nc1ccc2c(c1)NCCS2 Amb13881705 [0,1,0,1,0,0|1,0,1]=4 6839 B12R2.24 Nc1ccc2c(c1)cccn2 Amb1116987 [0,1,0,1,0,0|0,0,2]=4 6840 B12R2.24 Nc1ccc2c(n1)cccc2 Amb1152993 [0,1,0,1,0,0|0,0,2]=4 6841 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,1,0,1,0,0|2,0,0]=4 6842 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [0,1,0,1,0,0|2,0,0]=4 6843 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,1,0,1,0,0|1,0,1]=4 6844 B12R2.24 O=C1C=C2CN=CC=C2C=C1 Amb24407165 [0,1,0,1,0,0|2,0,0]=4 6845 B12R2.24 O=C1C=CC2=NCC=CC2=C1 Amb24090272 [0,1,0,1,0,0|0,0,1]=3 6846 B12R2.24 O=C1C=Cc2[n]cccc2N1 Amb21856966 [0,1,0,1,0,0|1,0,1]=4 6847 B12R2.24 O=C1C=Cc2c[n]ccc2N1 Amb21618693 [0,1,0,1,0,0|1,0,1]=4 6848 B12R2.24 O=C1C=Cc2cc[n]cc2N1 Amb22493786 [0,1,0,1,0,0|1,0,1]=4 6849 B12R2.24 O=C1C=Cc2ccc[n]c2N1 Amb22001403 [0,1,0,1,0,0|1,0,1]=4 6850 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,1,0,1,0,0|0,0,1]=3 6851 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,1,0,1,0,0|1,0,1]=4 6852 B12R2.24 O=C1C=Cc2ccccc2S1 Amb20663396 [0,1,0,1,0,0|1,0,1]=4 6853 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,1,0,1,0,0|0,0,2]=4 6854 B12R2.24 O=C1C=NC2=CCC=CC2=C1 Amb24078605 [0,1,0,1,0,0|2,0,0]=4 6855 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,1,0,1,0,0|1,0,1]=4 6856 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,1,0,1,0,0|1,0,1]=4 6857 B12R2.24 O=C1CNc2c[n]ccc2N1 Amb18202157 [0,1,0,1,0,0|2,0,0]=4 6858 B12R2.24 O=C1CNc2cc[n]cc2N1 Amb18025377 [0,1,0,1,0,0|2,0,0]=4 6859 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,1,0,1,0,0|1,0,0]=3 6860 B12R2.24 O=C1CNc2ncccc2N1 Amb17948510 [0,1,0,1,0,0|2,0,0]=4 6861 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,1,0,1,0,0|1,0,1]=4 6862 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,1,0,1,0,0|2,0,0]=4 6863 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [0,1,0,1,0,0|2,0,0]=4 6864 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,1,0,1,0,0|0,0,1]=3 6865 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [0,1,0,1,0,0|1,0,1]=4 6866 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [0,1,0,1,0,0|1,0,1]=4 6867 B12R2.24 O=C1Nc2ccccc2C=N1 Amb20653982 [0,1,0,1,0,0|1,0,1]=4 6868 B12R2.24 O=C1Nc2ccccc2C=N1 Amb22752711 [0,1,0,1,0,0|1,0,1]=4 6869 B12R2.24 O=[n]1cc2ccccc2cc1 Amb20247039 [0,1,0,1,0,0|2,0,0]=4 6870 B12R2.24 O=c1[nH]nc2c(c1)cccc2 Amb16204922 [0,1,0,1,0,0|1,0,1]=4 6871 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [0,1,0,1,0,0|1,0,1]=4 6872 B12R2.24 O=c1cnc2c([nH]1)cccc2 Amb1352017 [0,1,0,1,0,0|1,0,1]=4 6873 B12R2.24 O=c1ncc2c([nH]1)cccc2 Amb2569659 [0,1,0,1,0,0|1,0,1]=4 6874 B12R2.24 OC1=Nc2c(NC1)cccc2 Amb2373483 [0,1,0,1,0,0|1,0,0]=3 6875 B12R2.24 OC1C=Cc2ccccc2O1 Amb21964141 [0,1,0,1,0,0|1,0,0]=3 6876 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,1,0,1,0,0|1,0,1]=4 6877 B12R2.24 OC1Cc2[n]cccc2C=C1 Amb24091946 [0,1,0,1,0,0|2,0,0]=4 6878 B12R2.24 OC1Cc2ccc[n]c2C=C1 Amb24070853 [0,1,0,1,0,0|2,0,0]=4 6879 B12R2.24 OC1Cc2ccccc2NC1 Amb23590875 [0,1,0,1,0,0|0,0,2]=4 6880 B12R2.24 OC=1COc2ccccc2C1 Amb22498277 [0,1,0,1,0,0|1,0,0]=3 6881 B12R2.24 OC=1COc2ccccc2N1 Amb22330533 [0,1,0,1,0,0|2,0,0]=4 6882 B12R2.24 O[13c]1[13cH][13c]2[13cH][13cH][13cH][13cH][13c]2[13cH][13cH]1 Amb22055903 [0,1,0,1,0,0|1,0,1]=4 6883 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [0,1,0,1,0,0|1,0,0]=3 6884 B12R2.24 O[C@H]1Cc2ccccc2NC1 Amb24426871 [0,1,0,1,0,0|0,0,2]=4 6885 B12R2.24 Oc1cc2CCN=Cc2cc1 Amb25073966 [0,1,0,1,0,0|2,0,0]=4 6886 B12R2.24 Oc1cc2NCCOc2cc1 Amb21953873 [0,1,0,1,0,0|1,0,1]=4 6887 B12R2.24 Oc1cc2NCCOc2cc1 Amb22498359 [0,1,0,1,0,0|1,0,1]=4 6888 B12R2.24 Oc1cc2OCCNc2cc1 Amb22371507 [0,1,0,1,0,0|1,0,1]=4 6889 B12R2.24 Oc1cc2OCCNc2cc1 Amb22495584 [0,1,0,1,0,0|1,0,1]=4 6890 B12R2.24 Oc1cc2[n][n]ccc2cc1 Amb25319976 [0,1,0,1,0,0|1,0,1]=4 6891 B12R2.24 Oc1cc2c[n]ccc2cc1 Amb19373209 [0,1,0,1,0,0|2,0,0]=4 6892 B12R2.24 Oc1cc2ccccc2cc1 Amb21973568 [0,1,0,1,0,0|1,0,1]=4 6893 B12R2.24 Oc1ccc2OCC=Cc2c1 Amb18124873 [0,1,0,1,0,0|1,0,0]=3 6894 B12R2.24 Oc1ccc2c(c1)ccnc2 Amb10067627 [0,1,0,1,0,0|2,0,0]=4 6895 B12R2.24 Oc1ccc2c(c1)cncc2 Amb1152014 [0,1,0,1,0,0|2,0,0]=4 6896 B12R2.24 Oc1ccc2c(n1)cccc2 Amb1818223 [0,1,0,1,0,0|0,0,2]=4 6897 B12R2.24 Oc1ncc2c(c1)cccc2 Amb10068513 [0,1,0,1,0,0|2,0,0]=4 6898 B12R2.24 Oc1nnc2c(c1)cccc2 Amb10552926 [0,1,0,1,0,0|1,0,1]=4 6899 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [0,1,0,1,0,0|0,0,1]=3 6900 B12R2.24 S=C1C=Cc2ccccc2O1 Amb21884783 [0,1,0,1,0,0|1,0,1]=4 6901 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [0,1,0,1,0,0|1,0,1]=4 6902 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,1,0,1,0,0|2,0,0]=4 6903 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,1,0,1,0,0|2,0,0]=4 6904 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [0,1,0,1,0,0|2,0,0]=4 6905 B12R2.24 S=C1CSc2c(N1)cccc2 Amb1147064 [0,1,0,1,0,0|2,0,0]=4 6906 B12R2.24 S=C1Nc2ccccc2NN1 Amb25081092 [0,1,0,1,0,0|2,0,0]=4 6907 B12R2.24 S=c1ccc2ccccc2[s]1 Amb24065643 [0,1,0,1,0,0|1,0,1]=4 6908 B12R2.24 SN1Cc2ccccc2C=C1 Amb25826109 [0,1,0,1,0,0|2,0,0]=4 6909 B12R2.24 Sc1cc2NCCOc2cc1 Amb18664649 [0,1,0,1,0,0|1,0,1]=4 6910 B12R2.24 Sc1cc2c[n]ccc2cc1 Amb25150431 [0,1,0,1,0,0|2,0,0]=4 6911 B12R2.24 Sc1cc2ccc[n]c2cc1 Amb25076144 [0,1,0,1,0,0|0,0,2]=4 6912 B12R2.24 Sc1cc2ccccc2[n]c1 Amb23440777 [0,1,0,1,0,0|0,0,2]=4 6913 B12R2.24 Sc1cc2ccccc2c[n]1 Amb24624669 [0,1,0,1,0,0|2,0,0]=4 6914 B12R2.24 Sc1ccc2c(c1)cccc2 Amb1152959 [0,1,0,1,0,0|1,0,1]=4 6915 B12R2.24 Sc1ccc2c(n1)cccc2 Amb1151737 [0,1,0,1,0,0|0,0,2]=4 6916 B12R2.24 [13CH3][13c]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17617622 [0,1,0,1,0,0|1,0,1]=4 6917 B12R2.24 [Mg+]c1cc2ccccc2cc1 Amb22044011 [0,1,0,1,0,0|1,0,1]=4 6918 B12R2.24 [NH3+]c1cc2[13cH][13cH][13cH][13cH]c2cc1 Amb22057458 [0,1,0,1,0,0|1,0,1]=4 6919 B12R2.24 [O-]c1ccc2ccccc2[n]1 Amb22474102 [0,1,0,1,0,0|0,0,2]=4 6920 B12R2.24 [SiH3]c1cc2ccccc2[n]c1 Amb24102605 [0,1,0,1,0,0|0,0,2]=4 6921 B12R2.24 c1([2H])ccc2c(n1)cccc2 Amb10573520 [0,1,0,1,0,0|0,0,2]=4 6922 B12R2.132 Brc1c[nH]c2ccc(I)cc21 Amb24360421 [0,1,0,1,0,0|1,0,1]=4 6923 B12R2.132 Brc1cc2c(I)c[nH]c2cc1 Amb22736819 [0,1,0,1,0,0|1,0,1]=4 6924 B12R2.132 Brc1ccc2c(c1)C(=O)CC2 Amb2383532 [0,1,0,1,0,0|2,0,0]=4 6925 B12R2.132 Brc1ccc2c(c1)C(=O)CO2 Amb2383542 [0,1,0,1,0,0|2,0,0]=4 6926 B12R2.132 Brc1ccc2c(c1)c(C)c[nH]2 Amb2447301 [0,1,0,1,0,0|0,0,2]=4 6927 B12R2.132 Brc1ccc2c(c1)c(C)n[nH]2 Amb10070493 [0,1,0,1,0,0|1,0,1]=4 6928 B12R2.132 Brc1ccc2c(c1)c(N)c[nH]2 Amb10602219 [0,1,0,1,0,0|1,0,1]=4 6929 B12R2.132 C=C1CCc2ccc(Br)cc21 Amb24501876 [0,1,0,1,0,0|1,0,0]=3 6930 B12R2.132 CC1CNc2ccc(Br)cc21 Amb18561153 [0,1,0,1,0,0|0,0,2]=4 6931 B12R2.132 CC1CNc2ccc(Cl)cc21 Amb18063404 [0,1,0,1,0,0|0,0,2]=4 6932 B12R2.132 CC1CNc2ccc(F)cc21 Amb18063403 [0,1,0,1,0,0|0,0,2]=4 6933 B12R2.132 CN1CNc2ccc(Cl)cc12 Amb24464719 [0,1,0,1,0,0|1,0,1]=4 6934 B12R2.132 Cc1[n][nH]c2ccc(I)cc21 Amb22751749 [0,1,0,1,0,0|1,0,1]=4 6935 B12R2.132 Cc1c[nH]c2ccc(N)cc21 Amb24331783 [0,1,0,1,0,0|0,0,2]=4 6936 B12R2.132 Cc1cc2C(=O)CNc2cc1 Amb18202305 [0,1,0,1,0,0|1,0,0]=3 6937 B12R2.132 Cc1cc2C(=O)CSc2cc1 Amb18199752 [0,1,0,1,0,0|2,0,0]=4 6938 B12R2.132 Cc1cc2C(=O)NNc2cc1 Amb19748512 [0,1,0,1,0,0|2,0,0]=4 6939 B12R2.132 Cc1cc2C(=O)ONc2cc1 Amb25854553 [0,1,0,1,0,0|2,0,0]=4 6940 B12R2.132 Cc1cc2c(Br)c[nH]c2cc1 Amb20242775 [0,1,0,1,0,0|1,0,1]=4 6941 B12R2.132 Cc1cc2c(Cl)[n][nH]c2cc1 Amb25727198 [0,1,0,1,0,0|2,0,0]=4 6942 B12R2.132 Cc1cc2c(Cl)c[nH]c2cc1 Amb24759885 [0,1,0,1,0,0|1,0,1]=4 6943 B12R2.132 Cc1cc2c(F)c[nH]c2cc1 Amb24548257 [0,1,0,1,0,0|1,0,1]=4 6944 B12R2.132 Cc1cc2c(I)c[nH]c2cc1 Amb22500390 [0,1,0,1,0,0|1,0,1]=4 6945 B12R2.132 Cc1cc2c(N)[n][nH]c2cc1 Amb22057528 [0,1,0,1,0,0|2,0,0]=4 6946 B12R2.132 Cc1cc2c(N)c[nH]c2cc1 Amb18644283 [0,1,0,1,0,0|1,0,1]=4 6947 B12R2.132 Cc1cc2c(cc1)[nH][n]c2C Amb24386518 [0,1,0,1,0,0|1,0,1]=4 6948 B12R2.132 Cc1cc2c(cc1)[nH]cc2C Amb18243496 [0,1,0,1,0,0|0,0,2]=4 6949 B12R2.132 Cc1ccc2CCC(=C)c2c1 Amb24359347 [0,1,0,1,0,0|1,0,0]=3 6950 B12R2.132 Cc1ccc2c(c1)C(C)CN2 Amb17040660 [0,1,0,1,0,0|0,0,2]=4 6951 B12R2.132 Clc1c[nH]c2ccc(Br)cc21 Amb25699633 [0,1,0,1,0,0|1,0,1]=4 6952 B12R2.132 Clc1c[nH]c2ccc(I)cc21 Amb24717076 [0,1,0,1,0,0|1,0,1]=4 6953 B12R2.132 Clc1cc2c(I)c[nH]c2cc1 Amb23455966 [0,1,0,1,0,0|1,0,1]=4 6954 B12R2.132 Clc1cc2c(cc1)[nH]cc2Cl Amb24085521 [0,1,0,1,0,0|1,0,1]=4 6955 B12R2.132 Clc1ccc2c(c1)C(=O)CC2 Amb2383530 [0,1,0,1,0,0|2,0,0]=4 6956 B12R2.132 Clc1ccc2c(c1)C(=O)CO2 Amb2383540 [0,1,0,1,0,0|2,0,0]=4 6957 B12R2.132 Clc1ccc2c(c1)c(Br)c[nH]2 Amb15691710 [0,1,0,1,0,0|1,0,1]=4 6958 B12R2.132 Clc1ccc2c(c1)c(C)c[nH]2 Amb16185772 [0,1,0,1,0,0|0,0,2]=4 6959 B12R2.132 Clc1ccc2c(c1)c(C)n[nH]2 Amb10602903 [0,1,0,1,0,0|1,0,1]=4 6960 B12R2.132 Clc1ccc2c(c1)c(N)c[nH]2 Amb10603662 [0,1,0,1,0,0|1,0,1]=4 6961 B12R2.132 Fc1[n][nH]c2ccc(Br)cc21 Amb24056008 [0,1,0,1,0,0|2,0,0]=4 6962 B12R2.132 Fc1[n][nH]c2ccc(I)cc21 Amb24643863 [0,1,0,1,0,0|2,0,0]=4 6963 B12R2.132 Fc1c[nH]c2ccc(Br)cc21 Amb25280008 [0,1,0,1,0,0|1,0,1]=4 6964 B12R2.132 Fc1cc2c(Cl)c[nH]c2cc1 Amb25699632 [0,1,0,1,0,0|1,0,1]=4 6965 B12R2.132 Fc1cc2c(I)c[nH]c2cc1 Amb23455965 [0,1,0,1,0,0|1,0,1]=4 6966 B12R2.132 Fc1ccc2[nH]cc(Br)c2c1 Amb17739926 [0,1,0,1,0,0|1,0,1]=4 6967 B12R2.132 Fc1ccc2c(c1)C(=O)CC2 Amb2383531 [0,1,0,1,0,0|2,0,0]=4 6968 B12R2.132 Fc1ccc2c(c1)C(=O)CO2 Amb2383541 [0,1,0,1,0,0|2,0,0]=4 6969 B12R2.132 Fc1ccc2c(c1)c(C)n[nH]2 Amb13883697 [0,1,0,1,0,0|1,0,1]=4 6970 B12R2.132 Ic1ccc2c(c1)C(=O)CC2 Amb10603865 [0,1,0,1,0,0|2,0,0]=4 6971 B12R2.132 Ic1ccc2c(c1)c(N)n[nH]2 Amb10070573 [0,1,0,1,0,0|2,0,0]=4 6972 B12R2.132 NC1CNc2ccc(Cl)cc21 Amb25239513 [0,1,0,1,0,0|1,0,1]=4 6973 B12R2.132 Nc1[n][nH]c2ccc(Cl)cc21 Amb21858214 [0,1,0,1,0,0|2,0,0]=4 6974 B12R2.132 Nc1[n][nH]c2ccc(O)cc21 Amb24612382 [0,1,0,1,0,0|2,0,0]=4 6975 B12R2.132 Nc1c[nH]c2ccc(Br)cc21 Amb22739711 [0,1,0,1,0,0|1,0,1]=4 6976 B12R2.132 Nc1c[nH]c2ccc(O)cc21 Amb22757374 [0,1,0,1,0,0|1,0,1]=4 6977 B12R2.132 Nc1cc2C(=O)CSc2cc1 Amb18199702 [0,1,0,1,0,0|2,0,0]=4 6978 B12R2.132 Nc1cc2C(=O)NNc2cc1 Amb21959377 [0,1,0,1,0,0|2,0,0]=4 6979 B12R2.132 Nc1cc2c(F)c[nH]c2cc1 Amb24727234 [0,1,0,1,0,0|1,0,1]=4 6980 B12R2.132 Nc1cc2c(I)c[nH]c2cc1 Amb25329624 [0,1,0,1,0,0|1,0,1]=4 6981 B12R2.132 Nc1cc2c(O)[n][nH]c2cc1 Amb22587520 [0,1,0,1,0,0|2,0,0]=4 6982 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,1,0,0|2,0,0]=4 6983 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,1,0,0|2,0,0]=4 6984 B12R2.132 Nc1ccc2c(c1)c(Br)c[nH]2 Amb13953190 [0,1,0,1,0,0|1,0,1]=4 6985 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb18772113 [0,1,0,1,0,0|1,0,0]=3 6986 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb22831421 [0,1,0,1,0,0|1,0,0]=3 6987 B12R2.132 O=C1CNc2ccc(F)cc21 Amb18831267 [0,1,0,1,0,0|1,0,0]=3 6988 B12R2.132 O=C1CSc2ccc(Br)cc21 Amb18159426 [0,1,0,1,0,0|2,0,0]=4 6989 B12R2.132 O=C1CSc2ccc(Cl)cc21 Amb18822608 [0,1,0,1,0,0|2,0,0]=4 6990 B12R2.132 O=C1CSc2ccc(F)cc21 Amb18199304 [0,1,0,1,0,0|2,0,0]=4 6991 B12R2.132 O=C1NNc2ccc(Br)cc21 Amb22008691 [0,1,0,1,0,0|2,0,0]=4 6992 B12R2.132 O=C1NNc2ccc(Cl)cc21 Amb20460273 [0,1,0,1,0,0|2,0,0]=4 6993 B12R2.132 O=C1ONc2ccc(Cl)cc21 Amb22263320 [0,1,0,1,0,0|2,0,0]=4 6994 B12R2.132 OC1CNc2ccc(Br)cc21 Amb25352190 [0,1,0,1,0,0|1,0,1]=4 6995 B12R2.132 Oc1c[nH]c2ccc(Br)cc21 Amb22736747 [0,1,0,1,0,0|1,0,1]=4 6996 B12R2.132 Oc1c[nH]c2ccc(Cl)cc21 Amb25152744 [0,1,0,1,0,0|1,0,1]=4 6997 B12R2.132 Oc1c[nH]c2ccc(F)cc21 Amb25684717 [0,1,0,1,0,0|1,0,1]=4 6998 B12R2.132 Oc1c[nH]c2ccc(I)cc21 Amb24067430 [0,1,0,1,0,0|1,0,1]=4 6999 B12R2.132 Oc1cc2C(=O)CNc2cc1 Amb25115137 [0,1,0,1,0,0|1,0,0]=3 7000 B12R2.132 Oc1cc2C(=O)COc2cc1 Amb24061522 [0,1,0,1,0,0|2,0,0]=4 7001 B12R2.132 Oc1cc2c(Cl)c[nH]c2cc1 Amb24511714 [0,1,0,1,0,0|1,0,1]=4 7002 B12R2.132 Oc1ccc2c(c1)c(C)c[nH]2 Amb17593673 [0,1,0,1,0,0|0,0,2]=4 7003 B12R2.132 Oc1ccc2c(c1)c(C)n[nH]2 Amb15692034 [0,1,0,1,0,0|1,0,1]=4 7004 B12R2.132 [S-]c1c[nH]c2ccc(Cl)cc21 Amb25141992 [0,1,0,1,0,0|1,0,1]=4 7005 B12R2.217 C=C1COC12C=CC(=O)C=C2 Amb25188594 [0,1,0,1,0,0|1,0,1]=4 7006 B12R2.294 Cc1ccc(cc1)NC2CC2 Amb24623216 [0,1,0,1,0,0|0,0,2]=4 7007 B12R2.294 Clc1ccc(cc1)NC2CC2 Amb18267475 [0,1,0,1,0,0|0,0,2]=4 7008 B12R2.294 Fc1ccc(cc1)NC2CC2 Amb18267946 [0,1,0,1,0,0|0,0,2]=4 7009 B12R2.2302 Cc1ccc(cc1)C=2CCC2 Amb24672557 [0,1,0,1,0,0|1,0,1]=4 7010 B12R2.2302 Nc1ccc(cc1)N2CCC2 Amb22387333 [0,1,0,1,0,0|0,0,2]=4 7011 B12R2.2302 Oc1ccc(cc1)N2CCC2 Amb24579625 [0,1,0,1,0,0|0,0,2]=4 7012 B12R2.2 C1C=CC(N1)c2c[n]cc[n]2 Amb24458701 [0,1,0,1,0,0|2,0,0]=4 7013 B12R2.2 C1C=CC(N1)c2c[n]ccc2 Amb25076492 [0,1,0,1,0,0|1,0,0]=3 7014 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,1,0,1,0,0|0,0,0]=2 7015 B12R2.2 C1C=CCP1c2ccccc2 Amb25736369 [0,1,0,1,0,0|0,1,0]=3 7016 B12R2.2 C1C=CNC1c2c[n]ccc2 Amb24085149 [0,1,0,1,0,0|2,0,0]=4 7017 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,1,0,1,0,0|1,0,0]=3 7018 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,1,0,1,0,0|1,0,0]=3 7019 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,1,0,1,0,0|2,0,0]=4 7020 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,1,0,1,0,0|0,0,1]=3 7021 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,1,0,1,0,0|0,0,2]=4 7022 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,1,0,1,0,0|0,0,2]=4 7023 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,1,0,1,0,0|0,0,1]=3 7024 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,1,0,1,0,0|0,0,2]=4 7025 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,1,0,1,0,0|0,0,2]=4 7026 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,1,0,1,0,0|1,0,1]=4 7027 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,1,0,1,0,0|1,0,1]=4 7028 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,1,0,1,0,0|1,0,1]=4 7029 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,1,0,1,0,0|1,0,1]=4 7030 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,1,0,1,0,0|2,0,0]=4 7031 B12R2.2 C1OC=NN1c2c[n]ccc2 Amb24085088 [0,1,0,1,0,0|2,0,0]=4 7032 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,1,0,1,0,0|0,0,1]=3 7033 B12R2.2 c1[n][n](c[n]1)-c2c[n]ccc2 Amb24574578 [0,1,0,1,0,0|2,0,0]=4 7034 B12R2.2 c1[n][n][n]([n]1)-c2ccccc2 Amb25779582 [0,1,0,1,0,0|2,0,0]=4 7035 B12R2.2 c1[n]c[n][n]1-c2cc[n]cc2 Amb25365789 [0,1,0,1,0,0|2,0,0]=4 7036 B12R2.2 c1[n]cccc1-[n]2[n]cc[n]2 Amb24085197 [0,1,0,1,0,0|2,0,0]=4 7037 B12R2.2 c1[n]cccc1-[n]2cc[n][n]2 Amb24085121 [0,1,0,1,0,0|2,0,0]=4 7038 B12R2.2 c1[n]cccc1-[n]2ccc[n]2 Amb19515135 [0,1,0,1,0,0|1,0,1]=4 7039 B12R2.2 c1[n]cccc1-[n]2cccc2 Amb22741091 [0,1,0,1,0,0|1,0,1]=4 7040 B12R2.2 c1c[nH]c(n1)-c2ccccc2 Amb17842973 [0,1,0,1,0,0|1,0,1]=4 7041 B12R2.2 c1c[n]([n][n]1)-c2cccc[n]2 Amb25149423 [0,1,0,1,0,0|2,0,0]=4 7042 B12R2.2 c1c[n][n]([n]1)-c2cccc[n]2 Amb24070138 [0,1,0,1,0,0|2,0,0]=4 7043 B12R2.2 c1c[n]ccc1-c2ccc[nH]2 Amb24096984 [0,1,0,1,0,0|1,0,1]=4 7044 B12R2.2 c1cc(cc[n]1)-[n]2[n]cc[n]2 Amb24103027 [0,1,0,1,0,0|2,0,0]=4 7045 B12R2.2 c1cc(cc[n]1)-[n]2cc[n][n]2 Amb24102671 [0,1,0,1,0,0|2,0,0]=4 7046 B12R2.2 c1cc[n+](cc1)n2cccc2 Amb10553651 [0,1,0,1,0,0|1,0,1]=4 7047 B12R2.2 c1cc[n+](cc1)n2cccc2 Amb10553652 [0,1,0,1,0,0|1,0,1]=4 7048 B12R2.2 c1ccc(cc1)c2c[nH]cc2 Amb10606854 [0,1,0,1,0,0|1,0,1]=4 7049 B12R2.2 c1ccc(cc1)c2c[nH]cn2 Amb1294343 [0,1,0,1,0,0|2,0,0]=4 7050 B12R2.2 c1ccc(cc1)c2cccs2 Amb1215646 [0,1,0,1,0,0|1,0,1]=4 7051 B12R2.2 c1ccc(cc1)c2ccn[nH]2 Amb10235721 [0,1,0,1,0,0|1,0,0]=3 7052 B12R2.2 c1ccc(cc1)c2ccno2 Amb2191136 [0,1,0,1,0,0|2,0,0]=4 7053 B12R2.2 c1ccc(cc1)c2cncs2 Amb15691616 [0,1,0,1,0,0|2,0,0]=4 7054 B12R2.2 c1ccc(cc1)c2cocn2 Amb17399894 [0,1,0,1,0,0|2,0,0]=4 7055 B12R2.2 c1ccc(cc1)c2cscn2 Amb2234625 [0,1,0,1,0,0|2,0,0]=4 7056 B12R2.2 c1ccc(cc1)c2n[nH]cc2 Amb15740832 [0,1,0,1,0,0|1,0,1]=4 7057 B12R2.2 c1ccc(cc1)c2n[nH]cc2 Amb1818207 [0,1,0,1,0,0|1,0,1]=4 7058 B12R2.2 c1ccc(cc1)c2nccs2 Amb13884049 [0,1,0,1,0,0|2,0,0]=4 7059 B12R2.2 c1ccc(cc1)n2cccc2 Amb1879309 [0,1,0,1,0,0|0,0,1]=3 7060 B12R2.2 c1ccc(cc1)n2cccn2 Amb1157548 [0,1,0,1,0,0|0,0,1]=3 7061 B12R2.2 c1ccc(cc1)n2cncc2 Amb2413300 [0,1,0,1,0,0|0,0,1]=3 7062 B12R2.2 c1ccc(cc1)n2cncn2 Amb2237267 [0,1,0,1,0,0|1,0,0]=3 7063 B12R2.2 c1ccc(cc1)n2cnnn2 Amb2222042 [0,1,0,1,0,0|2,0,0]=4 7064 B12R2.2 c1ccc(cn1)n2cccc2 Amb2236511 [0,1,0,1,0,0|1,0,1]=4 7065 B12R2.2 c1ccc(cn1)n2cncc2 Amb2540105 [0,1,0,1,0,0|1,0,1]=4 7066 B12R2.2 c1ccc(nc1)c2ccc[nH]2 Amb1797845 [0,1,0,1,0,0|1,0,1]=4 7067 B12R2.2 c1ccc(nc1)c2ccn[nH]2 Amb15740857 [0,1,0,1,0,0|2,0,0]=4 7068 B12R2.2 c1ccc(nc1)n2cccc2 Amb2235020 [0,1,0,1,0,0|1,0,1]=4 7069 B12R2.2 c1ccc(nc1)n2cncc2 Amb2503950 [0,1,0,1,0,0|1,0,1]=4 7070 B12R2.2 c1ccccc1-c2[nH]cc[p]2 Amb24533180 [0,1,0,1,0,0|1,0,1]=4 7071 B12R2.2 c1ccccc1-c2cc[n][s]2 Amb24082008 [0,1,0,1,0,0|2,0,0]=4 7072 B12R2.2 c1ccccc1-c2cc[s][n]2 Amb24376714 [0,1,0,1,0,0|1,0,1]=4 7073 B12R2.2 c1ccccc1-c2cco[n]2 Amb19887522 [0,1,0,1,0,0|1,0,1]=4 7074 B12R2.2 c1ccccc1C2C=CC=C2 Amb24351108 [0,1,0,1,0,0|1,0,1]=4 7075 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [0,1,0,1,0,0|1,0,1]=4 7076 B12R2.2 n1ccc(cc1)c2ccn[nH]2 Amb10808662 [0,1,0,1,0,0|2,0,0]=4 7077 B12R2.22 BrC1CC(=C1)c2ccccc2 Amb24669104 [0,1,0,1,0,0|1,0,1]=4 7078 B12R2.22 C=C1CC(C1)c2cc[n]cc2 Amb24102821 [0,1,0,1,0,0|2,0,0]=4 7079 B12R2.22 NC1CN(C1)c2ccccc2 Amb23598844 [0,1,0,1,0,0|0,0,2]=4 7080 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,1,0,1,0,0|2,0,0]=4 7081 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,1,0,1,0,0|2,0,0]=4 7082 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,1,0,1,0,0|1,0,1]=4 7083 B12R2.22 OC1CN(C1)c2ccccc2 Amb23598700 [0,1,0,1,0,0|0,0,2]=4 7084 B12R2.27 C=CC1CC1c2cc[n]cc2 Amb24102778 [0,1,0,1,0,0|2,0,0]=4 7085 B12R2.27 C=CC1OC1c2cc[n]cc2 Amb24102825 [0,1,0,1,0,0|2,0,0]=4 7086 B12R2.27 C=CC1OC1c2ccc[n]c2 Amb24085248 [0,1,0,1,0,0|2,0,0]=4 7087 B12R2.27 C=CC1OC1c2cccc[n]2 Amb24100583 [0,1,0,1,0,0|2,0,0]=4 7088 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,1,0,1,0,0|1,0,0]=3 7089 B12R2.27 C=C[C@@H]1O[C@@H]1c2cccc[n]2 Amb24101989 [0,1,0,1,0,0|2,0,0]=4 7090 B12R2.27 C=C[C@H]1O[C@@H]1c2cccc[n]2 Amb24101986 [0,1,0,1,0,0|2,0,0]=4 7091 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|1,0,1]=4 7092 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,1,0,1,0,0|1,0,1]=4 7093 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [0,1,0,1,0,0|1,0,1]=4 7094 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,1,0,1,0,0|2,0,0]=4 7095 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,1,0,1,0,0|1,0,1]=4 7096 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|1,0,1]=4 7097 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,1,0,1,0,0|1,0,1]=4 7098 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [0,1,0,1,0,0|1,0,1]=4 7099 B12R2.1081 Bc1cccc2ccccc21 Amb24572623 [0,1,0,1,0,0|1,0,1]=4 7100 B12R2.1081 Brc1c[n][n]c2ccccc21 Amb22586082 [0,1,0,1,0,0|1,0,1]=4 7101 B12R2.1081 Brc1cccc2C=CCCc21 Amb22500941 [0,1,0,1,0,0|1,0,0]=3 7102 B12R2.1081 Brc1cccc2C=CCOc21 Amb25032493 [0,1,0,1,0,0|1,0,0]=3 7103 B12R2.1081 Brc1cccc2NCCNc21 Amb24647259 [0,1,0,1,0,0|1,0,1]=4 7104 B12R2.1081 Brc1cccc2NCCOc21 Amb21964594 [0,1,0,1,0,0|1,0,1]=4 7105 B12R2.1081 Brc1cccc2NCCSc21 Amb25715188 [0,1,0,1,0,0|1,0,1]=4 7106 B12R2.1081 Brc1cccc2SCCNc21 Amb22491567 [0,1,0,1,0,0|1,0,1]=4 7107 B12R2.1081 Brc1cccc2[n][n]ccc21 Amb22276043 [0,1,0,1,0,0|1,0,1]=4 7108 B12R2.1081 Brc1cccc2[n]cccc21 Amb22276929 [0,1,0,1,0,0|0,0,2]=4 7109 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,1,0,1,0,0|0,0,2]=4 7110 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,1,0,1,0,0|0,0,2]=4 7111 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,1,0,1,0,0|0,0,2]=4 7112 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,1,0,1,0,0|0,0,2]=4 7113 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,1,0,1,0,0|1,0,1]=4 7114 B12R2.1081 Brc1cccc2c1cccn2 Amb2234895 [0,1,0,1,0,0|0,0,2]=4 7115 B12R2.1081 Brc1cccc2c1cccn2 Amb2447603 [0,1,0,1,0,0|0,0,2]=4 7116 B12R2.1081 Brc1cccc2c1nccc2 Amb10601668 [0,1,0,1,0,0|0,0,2]=4 7117 B12R2.1081 Brc1cccc2c1nccc2 Amb2234896 [0,1,0,1,0,0|0,0,2]=4 7118 B12R2.1081 Brc1cccc2cc[n][n]c21 Amb21964130 [0,1,0,1,0,0|1,0,1]=4 7119 B12R2.1081 Brc1cccc2cc[n]cc21 Amb24184018 [0,1,0,1,0,0|2,0,0]=4 7120 B12R2.1081 Brc1ccnc2c1cccc2 Amb2447564 [0,1,0,1,0,0|0,0,2]=4 7121 B12R2.1081 C=C1C=CNc2ccc[n]c21 Amb24407157 [0,1,0,1,0,0|1,0,1]=4 7122 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [0,1,0,1,0,0|0,0,1]=3 7123 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,1,0,1,0,0|1,0,0]=3 7124 B12R2.1081 C=C1CCOc2[n]cccc21 Amb24414842 [0,1,0,1,0,0|2,0,0]=4 7125 B12R2.1081 C=C1CCOc2cc[n]cc21 Amb25047683 [0,1,0,1,0,0|2,0,0]=4 7126 B12R2.1081 C=C1CCOc2ccc[n]c21 Amb20241442 [0,1,0,1,0,0|2,0,0]=4 7127 B12R2.1081 C=C1CCSc2ccccc21 Amb25088063 [0,1,0,1,0,0|1,0,0]=3 7128 B12R2.1081 C=C1COCc2ccccc21 Amb24486797 [0,1,0,1,0,0|1,0,0]=3 7129 B12R2.1081 C=C1NCCc2ccccc21 Amb24685452 [0,1,0,1,0,0|1,0,0]=3 7130 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,1,0,1,0,0|1,0,0]=3 7131 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|1,0,0]=3 7132 B12R2.1081 CC1=COCc2ccccc21 Amb24436497 [0,1,0,1,0,0|2,0,0]=4 7133 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [0,1,0,1,0,0|1,0,1]=4 7134 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [0,1,0,1,0,0|0,0,2]=4 7135 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|0,0,2]=4 7136 B12R2.1081 CC1SC=Cc2ccccc21 Amb24485795 [0,1,0,1,0,0|2,0,0]=4 7137 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [0,1,0,1,0,0|0,0,2]=4 7138 B12R2.1081 CN1CCNc2c1cccc2 Amb2383679 [0,1,0,1,0,0|0,0,2]=4 7139 B12R2.1081 CN1CCNc2ccccc12 Amb19957895 [0,1,0,1,0,0|0,0,2]=4 7140 B12R2.1081 CN1CCNc2ccccc12 Amb22490719 [0,1,0,1,0,0|0,0,2]=4 7141 B12R2.1081 CN1CCOc2c1cccc2 Amb10569245 [0,1,0,1,0,0|1,0,1]=4 7142 B12R2.1081 CN1CCSc2ccccc12 Amb25220195 [0,1,0,1,0,0|1,0,1]=4 7143 B12R2.1081 C[C@@H]1CCNc2ccccc21 Amb25281259 [0,1,0,1,0,0|0,0,2]=4 7144 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [0,1,0,1,0,0|0,0,2]=4 7145 B12R2.1081 C[C@H]1CCNc2ccccc21 Amb24375115 [0,1,0,1,0,0|0,0,2]=4 7146 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [0,1,0,1,0,0|0,0,2]=4 7147 B12R2.1081 C[n+]1cccc2c1cccc2 Amb10553831 [0,1,0,1,0,0|0,0,2]=4 7148 B12R2.1081 C[n+]1cccc2c1cccc2 Amb2540187 [0,1,0,1,0,0|0,0,2]=4 7149 B12R2.1081 C[n+]1cccc2ccccc12 Amb22360002 [0,1,0,1,0,0|0,0,2]=4 7150 B12R2.1081 Cc1[n]ccc2ccccc21 Amb24074119 [0,1,0,1,0,0|2,0,0]=4 7151 B12R2.1081 Cc1c[n][n]c2ccccc21 Amb21964128 [0,1,0,1,0,0|1,0,1]=4 7152 B12R2.1081 Cc1cc[n]c2C=CCCc21 Amb24081299 [0,1,0,1,0,0|2,0,0]=4 7153 B12R2.1081 Cc1cccc2C=CCNc21 Amb18062161 [0,1,0,1,0,0|0,0,0]=2 7154 B12R2.1081 Cc1cccc2C=CCOc21 Amb23441445 [0,1,0,1,0,0|1,0,0]=3 7155 B12R2.1081 Cc1cccc2C=NCCc21 Amb25852737 [0,1,0,1,0,0|2,0,0]=4 7156 B12R2.1081 Cc1cccc2CCCNc21 Amb22499779 [0,1,0,1,0,0|0,0,2]=4 7157 B12R2.1081 Cc1cccc2CCN=Cc21 Amb25721127 [0,1,0,1,0,0|2,0,0]=4 7158 B12R2.1081 Cc1cccc2COCNc21 Amb25211934 [0,1,0,1,0,0|1,0,1]=4 7159 B12R2.1081 Cc1cccc2NCCCc21 Amb19957907 [0,1,0,1,0,0|0,0,2]=4 7160 B12R2.1081 Cc1cccc2NCCOc21 Amb22230187 [0,1,0,1,0,0|1,0,1]=4 7161 B12R2.1081 Cc1cccc2OCC=Cc21 Amb24484436 [0,1,0,1,0,0|1,0,0]=3 7162 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,1,0,1,0,0|0,0,2]=4 7163 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,1,0,1,0,0|0,0,2]=4 7164 B12R2.1081 Cc1cccc2c1OCCN2 Amb2383441 [0,1,0,1,0,0|1,0,1]=4 7165 B12R2.1081 Cc1cccc2c1cccn2 Amb2447286 [0,1,0,1,0,0|0,0,2]=4 7166 B12R2.1081 Cc1cccc2c1ccnc2 Amb2447327 [0,1,0,1,0,0|2,0,0]=4 7167 B12R2.1081 Cc1cccc2c1cncc2 Amb10070397 [0,1,0,1,0,0|2,0,0]=4 7168 B12R2.1081 Cc1cccc2c1nccc2 Amb1229978 [0,1,0,1,0,0|0,0,2]=4 7169 B12R2.1081 Cc1cccc2c1nncc2 Amb15691610 [0,1,0,1,0,0|1,0,1]=4 7170 B12R2.1081 Cc1cncc2c1cccc2 Amb15691609 [0,1,0,1,0,0|2,0,0]=4 7171 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,1,0,1,0,0|2,0,0]=4 7172 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,1,0,1,0,0|0,0,2]=4 7173 B12R2.1081 Clc1cccc2C=CCNc21 Amb18062185 [0,1,0,1,0,0|0,0,0]=2 7174 B12R2.1081 Clc1cccc2C=CCOc21 Amb22586336 [0,1,0,1,0,0|1,0,0]=3 7175 B12R2.1081 Clc1cccc2CCCNc21 Amb19373263 [0,1,0,1,0,0|0,0,2]=4 7176 B12R2.1081 Clc1cccc2CCN=Cc21 Amb24578663 [0,1,0,1,0,0|2,0,0]=4 7177 B12R2.1081 Clc1cccc2NCCCc21 Amb19957902 [0,1,0,1,0,0|0,0,2]=4 7178 B12R2.1081 Clc1cccc2NCCNc21 Amb25282036 [0,1,0,1,0,0|1,0,1]=4 7179 B12R2.1081 Clc1cccc2NCCSc21 Amb22886397 [0,1,0,1,0,0|1,0,1]=4 7180 B12R2.1081 Clc1cccc2SCCNc21 Amb22886398 [0,1,0,1,0,0|1,0,1]=4 7181 B12R2.1081 Clc1cccc2c1CCC=C2 Amb2383775 [0,1,0,1,0,0|1,0,0]=3 7182 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,1,0,1,0,0|0,0,2]=4 7183 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,1,0,1,0,0|0,0,2]=4 7184 B12R2.1081 Clc1cccc2c1OCCN2 Amb2383435 [0,1,0,1,0,0|1,0,1]=4 7185 B12R2.1081 Clc1cccc2c1cccn2 Amb2369016 [0,1,0,1,0,0|0,0,2]=4 7186 B12R2.1081 Clc1cccc2c1ccnc2 Amb10067233 [0,1,0,1,0,0|2,0,0]=4 7187 B12R2.1081 Clc1cccc2c1cncc2 Amb10067628 [0,1,0,1,0,0|2,0,0]=4 7188 B12R2.1081 Clc1ccnc2c1cccc2 Amb1033000 [0,1,0,1,0,0|0,0,2]=4 7189 B12R2.1081 Clc1nccc2c1cccc2 Amb2196515 [0,1,0,1,0,0|2,0,0]=4 7190 B12R2.1081 FC1CNCc2c1cccc2 Amb10841578 [0,1,0,1,0,0|1,0,1]=4 7191 B12R2.1081 Fc1[n]ccc2ccccc21 Amb24673352 [0,1,0,1,0,0|2,0,0]=4 7192 B12R2.1081 Fc1c[n]cc2ccccc21 Amb22396493 [0,1,0,1,0,0|2,0,0]=4 7193 B12R2.1081 Fc1cc[n]c2ccccc21 Amb21960885 [0,1,0,1,0,0|0,0,2]=4 7194 B12R2.1081 Fc1cccc2C=CCNc21 Amb18062053 [0,1,0,1,0,0|0,0,0]=2 7195 B12R2.1081 Fc1cccc2C=CCOc21 Amb22586337 [0,1,0,1,0,0|1,0,0]=3 7196 B12R2.1081 Fc1cccc2C=NCCc21 Amb24563509 [0,1,0,1,0,0|2,0,0]=4 7197 B12R2.1081 Fc1cccc2NCCCc21 Amb19958505 [0,1,0,1,0,0|0,0,2]=4 7198 B12R2.1081 Fc1cccc2OCCNc21 Amb18831161 [0,1,0,1,0,0|1,0,1]=4 7199 B12R2.1081 Fc1cccc2c1CCC=C2 Amb2383776 [0,1,0,1,0,0|1,0,0]=3 7200 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,1,0,1,0,0|0,0,2]=4 7201 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,1,0,1,0,0|0,0,2]=4 7202 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,1,0,1,0,0|0,0,2]=4 7203 B12R2.1081 Fc1cccc2c1OCCN2 Amb10603942 [0,1,0,1,0,0|1,0,1]=4 7204 B12R2.1081 Fc1cccc2c1OCCN2 Amb2383436 [0,1,0,1,0,0|1,0,1]=4 7205 B12R2.1081 Fc1cccc2c1ccnc2 Amb10573349 [0,1,0,1,0,0|2,0,0]=4 7206 B12R2.1081 Fc1cccc2c1cncc2 Amb10839616 [0,1,0,1,0,0|2,0,0]=4 7207 B12R2.1081 Fc1cccc2cc[n][n]c21 Amb24092308 [0,1,0,1,0,0|1,0,1]=4 7208 B12R2.1081 Fc1cccc2ccc[n]c21 Amb22235972 [0,1,0,1,0,0|0,0,2]=4 7209 B12R2.1081 Fc1ccnc2c1cccc2 Amb10067580 [0,1,0,1,0,0|0,0,2]=4 7210 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,1,0,1,0,0|0,0,2]=4 7211 B12R2.1081 Ic1cccc2NCCCc21 Amb22586210 [0,1,0,1,0,0|0,0,2]=4 7212 B12R2.1081 Ic1cccc2NCCOc21 Amb22586347 [0,1,0,1,0,0|1,0,1]=4 7213 B12R2.1081 Ic1cccc2c1CCCN2 Amb2383337 [0,1,0,1,0,0|0,0,2]=4 7214 B12R2.1081 Ic1cccc2c1OCCN2 Amb2383443 [0,1,0,1,0,0|1,0,1]=4 7215 B12R2.1081 Ic1cccc2cc[n]cc21 Amb22495459 [0,1,0,1,0,0|2,0,0]=4 7216 B12R2.1081 NC1=NCCc2ccccc21 Amb18644285 [0,1,0,1,0,0|2,0,0]=4 7217 B12R2.1081 NC1=NCNc2ccccc21 Amb24099678 [0,1,0,1,0,0|1,0,0]=3 7218 B12R2.1081 NC1CC=Cc2ccccc21 Amb24385870 [0,1,0,1,0,0|1,0,0]=3 7219 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,1,0,1,0,0|0,0,2]=4 7220 B12R2.1081 NC1CCNc2ccccc21 Amb22757242 [0,1,0,1,0,0|0,0,2]=4 7221 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,1,0,1,0,0|1,0,1]=4 7222 B12R2.1081 NC1CNCc2ccccc21 Amb22494720 [0,1,0,1,0,0|1,0,1]=4 7223 B12R2.1081 NC1CNCc2ccccc21 Amb22494721 [0,1,0,1,0,0|1,0,1]=4 7224 B12R2.1081 NC=1NCN=C2C=CC=CC21 Amb24748169 [0,1,0,1,0,0|1,0,1]=4 7225 B12R2.1081 NN1CC=Cc2ccccc12 Amb24060055 [0,1,0,1,0,0|0,0,0]=2 7226 B12R2.1081 NN1CCOc2ccccc12 Amb18125145 [0,1,0,1,0,0|1,0,1]=4 7227 B12R2.1081 NN1CCOc2ccccc12 Amb22228837 [0,1,0,1,0,0|1,0,1]=4 7228 B12R2.1081 NN1CCSc2ccccc12 Amb24454763 [0,1,0,1,0,0|1,0,1]=4 7229 B12R2.1081 N[13c]1[13cH][13cH][13cH][13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22057463 [0,1,0,1,0,0|1,0,1]=4 7230 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,1,0,1,0,0|0,0,2]=4 7231 B12R2.1081 N[n+]1cccc2c1cccc2 Amb10553640 [0,1,0,1,0,0|0,0,2]=4 7232 B12R2.1081 N[n+]1cccc2c1cccc2 Amb10553663 [0,1,0,1,0,0|0,0,2]=4 7233 B12R2.1081 N[n+]1cccc2c1cccc2 Amb2237833 [0,1,0,1,0,0|0,0,2]=4 7234 B12R2.1081 Nc1c[n]cc2ccccc21 Amb22276925 [0,1,0,1,0,0|2,0,0]=4 7235 B12R2.1081 Nc1cccc2C=CCCc21 Amb18644206 [0,1,0,1,0,0|1,0,0]=3 7236 B12R2.1081 Nc1cccc2CCCNc21 Amb22494247 [0,1,0,1,0,0|0,0,2]=4 7237 B12R2.1081 Nc1cccc2NN=CCc21 Amb18644332 [0,1,0,1,0,0|1,0,1]=4 7238 B12R2.1081 Nc1cccc2OCC=Nc21 Amb24093680 [0,1,0,1,0,0|2,0,0]=4 7239 B12R2.1081 Nc1cccc2[n][n]ccc21 Amb21857231 [0,1,0,1,0,0|1,0,1]=4 7240 B12R2.1081 Nc1cccc2[n]cccc21 Amb22276926 [0,1,0,1,0,0|0,0,2]=4 7241 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|1,0,0]=3 7242 B12R2.1081 Nc1cccc2c1CCCN2 Amb17232045 [0,1,0,1,0,0|0,0,2]=4 7243 B12R2.1081 Nc1cccc2c1NCCO2 Amb16191975 [0,1,0,1,0,0|1,0,1]=4 7244 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|1,0,0]=3 7245 B12R2.1081 Nc1cccc2c1OCCN2 Amb10067597 [0,1,0,1,0,0|1,0,1]=4 7246 B12R2.1081 Nc1cccc2c1cccc2 Amb1935098 [0,1,0,1,0,0|1,0,1]=4 7247 B12R2.1081 Nc1cccc2c1cccn2 Amb1151787 [0,1,0,1,0,0|0,0,2]=4 7248 B12R2.1081 Nc1cccc2c1ccnc2 Amb1157144 [0,1,0,1,0,0|2,0,0]=4 7249 B12R2.1081 Nc1cccc2c1nccc2 Amb1056132 [0,1,0,1,0,0|0,0,2]=4 7250 B12R2.1081 Nc1cccc2cc[n][n]c21 Amb21857233 [0,1,0,1,0,0|1,0,1]=4 7251 B12R2.1081 Nc1cccc2cc[n]cc21 Amb22756321 [0,1,0,1,0,0|2,0,0]=4 7252 B12R2.1081 Nc1ccnc2c1cccc2 Amb1102727 [0,1,0,1,0,0|0,0,2]=4 7253 B12R2.1081 O=C1C=CC=C2NC=NC=C21 Amb24617550 [0,1,0,1,0,0|1,0,1]=4 7254 B12R2.1081 O=C1C=CCc2c1cccc2 Amb2388336 [0,1,0,1,0,0|1,0,1]=4 7255 B12R2.1081 O=C1C=CN=C2C=CCC=C21 Amb24062892 [0,1,0,1,0,0|2,0,0]=4 7256 B12R2.1081 O=C1C=CNc2[n]cccc21 Amb22490480 [0,1,0,1,0,0|1,0,1]=4 7257 B12R2.1081 O=C1C=CNc2[n]cccc21 Amb22490488 [0,1,0,1,0,0|1,0,1]=4 7258 B12R2.1081 O=C1C=CNc2c[n]ccc21 Amb22055906 [0,1,0,1,0,0|1,0,1]=4 7259 B12R2.1081 O=C1C=CNc2cc[n]cc21 Amb20623103 [0,1,0,1,0,0|1,0,1]=4 7260 B12R2.1081 O=C1C=CNc2ccc[n]c21 Amb22489921 [0,1,0,1,0,0|1,0,1]=4 7261 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,1,0,1,0,0|0,0,1]=3 7262 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,1,0,1,0,0|1,0,1]=4 7263 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,1,0,1,0,0|1,0,1]=4 7264 B12R2.1081 O=C1C=C[Se]c2ccccc21 Amb22551504 [0,1,0,1,0,0|1,0,1]=4 7265 B12R2.1081 O=C1C=NCc2ccccc21 Amb25717685 [0,1,0,1,0,0|2,0,0]=4 7266 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,1,0,1,0,0|1,0,0]=3 7267 B12R2.1081 O=C1C=NOc2ccccc21 Amb25713023 [0,1,0,1,0,0|2,0,0]=4 7268 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,1,0,1,0,0|1,0,1]=4 7269 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [0,1,0,1,0,0|1,0,1]=4 7270 B12R2.1081 O=C1CCNc2c1cccc2 Amb10067080 [0,1,0,1,0,0|0,0,1]=3 7271 B12R2.1081 O=C1CCNc2c1cccn2 Amb16233465 [0,1,0,1,0,0|1,0,1]=4 7272 B12R2.1081 O=C1CCNc2c[n]ccc21 Amb24631913 [0,1,0,1,0,0|1,0,1]=4 7273 B12R2.1081 O=C1CCOc2c1cccc2 Amb1153759 [0,1,0,1,0,0|1,0,1]=4 7274 B12R2.1081 O=C1CCSc2c1cccc2 Amb1151631 [0,1,0,1,0,0|1,0,1]=4 7275 B12R2.1081 O=C1CNCc2[n]cccc21 Amb18202251 [0,1,0,1,0,0|2,0,0]=4 7276 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,1,0,1,0,0|1,0,0]=3 7277 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,1,0,1,0,0|1,0,0]=3 7278 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,1,0,1,0,0|1,0,0]=3 7279 B12R2.1081 O=C1CNOc2ccccc21 Amb25086617 [0,1,0,1,0,0|1,0,0]=3 7280 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [0,1,0,1,0,0|2,0,0]=4 7281 B12R2.1081 O=C1N=CC=C2C=CCC=C21 Amb24060242 [0,1,0,1,0,0|2,0,0]=4 7282 B12R2.1081 O=C1N=CC=C2NC=CC=C21 Amb22284375 [0,1,0,1,0,0|1,0,1]=4 7283 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,1,0,1,0,0|2,0,0]=4 7284 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,1,0,1,0,0|2,0,0]=4 7285 B12R2.1081 O=C1NCCc2c1cccc2 Amb2502473 [0,1,0,1,0,0|2,0,0]=4 7286 B12R2.1081 O=C1NCNc2[n]cccc21 Amb24101585 [0,1,0,1,0,0|2,0,0]=4 7287 B12R2.1081 O=C1NCNc2cc[n]cc21 Amb24419756 [0,1,0,1,0,0|2,0,0]=4 7288 B12R2.1081 O=C1NCOc2ccccc21 Amb24104580 [0,1,0,1,0,0|2,0,0]=4 7289 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,1,0,1,0,0|2,0,0]=4 7290 B12R2.1081 O=C1OCCc2c1cccc2 Amb16232507 [0,1,0,1,0,0|2,0,0]=4 7291 B12R2.1081 O=C1OCOc2ccccc21 Amb24066081 [0,1,0,1,0,0|2,0,0]=4 7292 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,1,0,1,0,0|2,0,0]=4 7293 B12R2.1081 O=S1CCNc2c1cccc2 Amb1106281 [0,1,0,1,0,0|1,0,1]=4 7294 B12R2.1081 O=c1[nH]ccc2c1cccc2 Amb1152413 [0,1,0,1,0,0|2,0,0]=4 7295 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,1,0,1,0,0|1,0,0]=3 7296 B12R2.1081 OC1=COCc2c1cccc2 Amb10603427 [0,1,0,1,0,0|2,0,0]=4 7297 B12R2.1081 OC1CC=Cc2[n]cccc21 Amb24070852 [0,1,0,1,0,0|2,0,0]=4 7298 B12R2.1081 OC1CC=Cc2ccc[n]c21 Amb24091947 [0,1,0,1,0,0|2,0,0]=4 7299 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,1,0,1,0,0|1,0,0]=3 7300 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [0,1,0,1,0,0|0,0,2]=4 7301 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|0,0,2]=4 7302 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [0,1,0,1,0,0|0,0,2]=4 7303 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [0,1,0,1,0,0|1,0,1]=4 7304 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|1,0,1]=4 7305 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,1,0,1,0,0|0,0,2]=4 7306 B12R2.1081 O[13c]1[13cH][13cH][13cH][13c]2[13c]1[13cH][13cH][13cH][13cH]2 Amb17618239 [0,1,0,1,0,0|1,0,1]=4 7307 B12R2.1081 O[14c]1cccc2ccccc12 Amb22352351 [0,1,0,1,0,0|1,0,1]=4 7308 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [0,1,0,1,0,0|1,0,1]=4 7309 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|1,0,1]=4 7310 B12R2.1081 Oc1[n]ccc2ccccc21 Amb22347767 [0,1,0,1,0,0|2,0,0]=4 7311 B12R2.1081 Oc1c[n]cc2ccccc21 Amb21964404 [0,1,0,1,0,0|2,0,0]=4 7312 B12R2.1081 Oc1cc[n]c2ccccc21 Amb22450352 [0,1,0,1,0,0|0,0,2]=4 7313 B12R2.1081 Oc1cccc2C=CCCc21 Amb18644266 [0,1,0,1,0,0|1,0,0]=3 7314 B12R2.1081 Oc1cccc2CCC=Cc21 Amb18644265 [0,1,0,1,0,0|1,0,0]=3 7315 B12R2.1081 Oc1cccc2NCCCc21 Amb18124994 [0,1,0,1,0,0|0,0,2]=4 7316 B12R2.1081 Oc1cccc2NCCNc21 Amb20080169 [0,1,0,1,0,0|1,0,1]=4 7317 B12R2.1081 Oc1cccc2OCC=Cc21 Amb18124878 [0,1,0,1,0,0|1,0,0]=3 7318 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,1,0,1,0,0|0,0,2]=4 7319 B12R2.1081 Oc1cccc2c1[nH+]ccc2 Amb10807807 [0,1,0,1,0,0|0,0,2]=4 7320 B12R2.1081 Oc1cccc2c1nccc2 Amb10071350 [0,1,0,1,0,0|0,0,2]=4 7321 B12R2.1081 Oc1cccc2c1nccc2 Amb10843705 [0,1,0,1,0,0|0,0,2]=4 7322 B12R2.1081 Oc1cccc2c1nccc2 Amb1151957 [0,1,0,1,0,0|0,0,2]=4 7323 B12R2.1081 Oc1cccc2cc[n][n]c21 Amb24601328 [0,1,0,1,0,0|1,0,1]=4 7324 B12R2.1081 Oc1cccc2ccc[nH+]c21 Amb20246575 [0,1,0,1,0,0|0,0,2]=4 7325 B12R2.1081 Oc1cccc2ccc[n]c12 Amb22167517 [0,1,0,1,0,0|0,0,2]=4 7326 B12R2.1081 Oc1cccc2ccc[n]c12 Amb24096675 [0,1,0,1,0,0|0,0,2]=4 7327 B12R2.1081 Oc1cccc2ccc[n]c21 Amb20621451 [0,1,0,1,0,0|0,0,2]=4 7328 B12R2.1081 Oc1cccc2ccc[n]c21 Amb24062965 [0,1,0,1,0,0|0,0,2]=4 7329 B12R2.1081 Oc1cccc2cccnc12 Amb17942951 [0,1,0,1,0,0|0,0,2]=4 7330 B12R2.1081 Oc1cncc2c1cccc2 Amb10553148 [0,1,0,1,0,0|2,0,0]=4 7331 B12R2.1081 Oc1cnnc2c1cccc2 Amb2371264 [0,1,0,1,0,0|1,0,1]=4 7332 B12R2.1081 Pc1cccc2ccccc21 Amb24739753 [0,1,0,1,0,0|1,0,1]=4 7333 B12R2.1081 S=C1C=CC=C2NC=CC=C21 Amb25169601 [0,1,0,1,0,0|0,0,1]=3 7334 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [0,1,0,1,0,0|0,0,1]=3 7335 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [0,1,0,1,0,0|1,0,0]=3 7336 B12R2.1081 S=c1cc[nH]c2c1cccc2 Amb10553628 [0,1,0,1,0,0|0,0,1]=3 7337 B12R2.1081 Sc1ccnc2c1cccc2 Amb10603792 [0,1,0,1,0,0|0,0,2]=4 7338 B12R2.1081 Sc1cnnc2c1cccc2 Amb2371342 [0,1,0,1,0,0|1,0,1]=4 7339 B12R2.1081 [Mg+]c1cccc2ccccc21 Amb22044005 [0,1,0,1,0,0|1,0,1]=4 7340 B12R2.1081 [Na]c1cccc2ccccc21 Amb24485785 [0,1,0,1,0,0|1,0,1]=4 7341 B12R2.1081 [O-]c1cccc2c1nccc2 Amb10071661 [0,1,0,1,0,0|0,0,2]=4 7342 B12R2.1081 [O-]c1cccc2ccc[n]c12 Amb22052464 [0,1,0,1,0,0|0,0,2]=4 7343 B12R2.1081 [O-]c1cccc2ccc[n]c12 Amb22057291 [0,1,0,1,0,0|0,0,2]=4 7344 B12R2.1081 [O-]c1cccc2ccc[n]c12 Amb22057292 [0,1,0,1,0,0|0,0,2]=4 7345 B12R2.1081 [O-]c1cccc2ccc[n]c12 Amb22466862 [0,1,0,1,0,0|0,0,2]=4 7346 B12R2.1081 [O-]c1cccc2ccc[n]c12 Amb22466987 [0,1,0,1,0,0|0,0,2]=4 7347 B12R2.1081 [O-]c1cccc2ccc[n]c12 Amb22474101 [0,1,0,1,0,0|0,0,2]=4 7348 B12R2.1081 [O-]c1cccc2ccc[n]c21 Amb22167197 [0,1,0,1,0,0|0,0,2]=4 7349 B12R2.1081 [S-]c1cccc2c1nccc2 Amb1033051 [0,1,0,1,0,0|0,0,2]=4 7350 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,1,0,1,0,0|1,0,0]=3 7351 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,1,0,1,0,0|1,0,0]=3 7352 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb20671447 [0,1,0,1,0,0|2,0,0]=4 7353 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,1,0,1,0,0|2,0,0]=4 7354 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,1,0,1,0,0|0,0,2]=4 7355 B12R2.2028 CN1CC(O)c2ccccc12 Amb24632103 [0,1,0,1,0,0|1,0,1]=4 7356 B12R2.2028 CN1CN(C)c2ccccc12 Amb24092822 [0,1,0,1,0,0|1,0,1]=4 7357 B12R2.2028 CN1NC(=O)c2ccccc12 Amb22372319 [0,1,0,1,0,0|2,0,0]=4 7358 B12R2.2028 CN1OC(=O)c2ccccc12 Amb24528970 [0,1,0,1,0,0|2,0,0]=4 7359 B12R2.2028 CN1SC(=O)c2ccccc12 Amb19664923 [0,1,0,1,0,0|2,0,0]=4 7360 B12R2.2028 CN1SC(=S)c2ccccc12 Amb20661436 [0,1,0,1,0,0|2,0,0]=4 7361 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|2,0,0]=4 7362 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|2,0,0]=4 7363 B12R2.2028 C[n]1[n]c(Cl)c2ccccc12 Amb25327391 [0,1,0,1,0,0|2,0,0]=4 7364 B12R2.2028 C[n]1cc(I)c2ccccc12 Amb24067581 [0,1,0,1,0,0|1,0,1]=4 7365 B12R2.2028 C[n]1cc(N)c2ccccc12 Amb18064415 [0,1,0,1,0,0|1,0,1]=4 7366 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [0,1,0,1,0,0|1,0,1]=4 7367 B12R2.2028 C[n]1cc(S)c2ccccc12 Amb25721189 [0,1,0,1,0,0|1,0,1]=4 7368 B12R2.2028 Cc1[n][n](C)c2ccccc12 Amb22491231 [0,1,0,1,0,0|1,0,1]=4 7369 B12R2.2028 Cc1c[n](N)c2ccccc21 Amb24608862 [0,1,0,1,0,0|0,0,2]=4 7370 B12R2.2028 Cn1nc(c2c1cccc2)Br Amb10604243 [0,1,0,1,0,0|2,0,0]=4 7371 B12R2.2028 Cn1nc(c2c1cccc2)I Amb10608014 [0,1,0,1,0,0|2,0,0]=4 7372 B12R2.2028 N=C1CN(O)c2ccccc21 Amb24078909 [0,1,0,1,0,0|1,0,0]=3 7373 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|2,0,0]=4 7374 B12R2.2028 N[n]1[n]c(Br)c2ccccc12 Amb24741933 [0,1,0,1,0,0|2,0,0]=4 7375 B12R2.2028 N[n]1[n]c(I)c2ccccc12 Amb24615979 [0,1,0,1,0,0|2,0,0]=4 7376 B12R2.2028 Nc1[n][n](N)c2ccccc12 Amb24089069 [0,1,0,1,0,0|2,0,0]=4 7377 B12R2.2028 O=C1CC(=O)c2c1cccc2 Amb1883008 [0,1,0,1,0,0|2,0,0]=4 7378 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,1,0,1,0,0|2,0,0]=4 7379 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,1,0,1,0,0|2,0,0]=4 7380 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,1,0,1,0,0|1,0,0]=3 7381 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,1,0,1,0,0|2,0,0]=4 7382 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,1,0,1,0,0|2,0,0]=4 7383 B12R2.32 C=Cc1[n]c2ccccc2[s]1 Amb24085073 [0,1,0,1,0,0|0,0,2]=4 7384 B12R2.32 C=Cc1[n]c2ccccc2o1 Amb24602813 [0,1,0,1,0,0|0,0,2]=4 7385 B12R2.32 C=Cc1cc2ccccc2o1 Amb24470459 [0,1,0,1,0,0|1,0,1]=4 7386 B12R2.32 C=Cn1nc2c(n1)cccc2 Amb10559273 [0,1,0,1,0,0|1,0,1]=4 7387 B12R2.32 CCC1Nc2ccccc2N1 Amb25374201 [0,1,0,1,0,0|0,0,2]=4 7388 B12R2.32 CCC1Nc2ccccc2S1 Amb24086400 [0,1,0,1,0,0|0,0,2]=4 7389 B12R2.32 COC1Nc2ccccc2S1 Amb24084534 [0,1,0,1,0,0|1,0,1]=4 7390 B12R2.32 C\C=C/1\Nc2ccccc2S1 Amb25351957 [0,1,0,1,0,0|0,0,2]=4 7391 B12R2.32 FCC1Cc2ccccc2N1 Amb25276456 [0,1,0,1,0,0|1,0,1]=4 7392 B12R2.32 FC[C@@H]1Cc2ccccc2N1 Amb25041577 [0,1,0,1,0,0|1,0,1]=4 7393 B12R2.32 ICC1Cc2ccccc2N1 Amb24061262 [0,1,0,1,0,0|1,0,1]=4 7394 B12R2.32 NCC1Nc2ccccc2N1 Amb24334873 [0,1,0,1,0,0|1,0,1]=4 7395 B12R2.32 O=CC1C=C2C=CC=CN2N1 Amb24486973 [0,1,0,1,0,0|2,0,0]=4 7396 B12R2.32 O=CC1C=c2ccccc2=C1 Amb24100778 [0,1,0,1,0,0|2,0,0]=4 7397 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [0,1,0,1,0,0|2,0,0]=4 7398 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|1,0,1]=4 7399 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|1,0,1]=4 7400 B12R2.32 ONC1Nc2ccccc2O1 Amb24523067 [0,1,0,1,0,0|2,0,0]=4 7401 B12R2.32 S=Cc1[nH]c2ccccc2[n]1 Amb24465108 [0,1,0,1,0,0|1,0,1]=4 7402 B12R2.196 Brc1[n][nH]c2c(I)cccc21 Amb22496065 [0,1,0,1,0,0|2,0,0]=4 7403 B12R2.196 Brc1c[nH]c2c1cccc2C Amb15691711 [0,1,0,1,0,0|1,0,1]=4 7404 B12R2.196 Brc1cccc2c(I)c[nH]c21 Amb22008414 [0,1,0,1,0,0|1,0,1]=4 7405 B12R2.196 Brc1cccc2c1[nH][n]c2Br Amb23400862 [0,1,0,1,0,0|2,0,0]=4 7406 B12R2.196 Brc1cccc2c1[nH]cc2Br Amb24067563 [0,1,0,1,0,0|1,0,1]=4 7407 B12R2.196 Brc1cccc2c1[nH]nc2C Amb10070864 [0,1,0,1,0,0|1,0,1]=4 7408 B12R2.196 Brc1cccc2c1[nH]nc2Cl Amb10603433 [0,1,0,1,0,0|2,0,0]=4 7409 B12R2.196 C=C1CCc2c(Br)cccc21 Amb24380342 [0,1,0,1,0,0|1,0,0]=3 7410 B12R2.196 C=C1CCc2c(Cl)cccc21 Amb22229727 [0,1,0,1,0,0|1,0,0]=3 7411 B12R2.196 C=C1CCc2c(F)cccc21 Amb24334153 [0,1,0,1,0,0|1,0,0]=3 7412 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,1,0,1,0,0|0,0,2]=4 7413 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,1,0,1,0,0|0,0,2]=4 7414 B12R2.196 CC1CNc2c1cccc2C Amb17040659 [0,1,0,1,0,0|0,0,2]=4 7415 B12R2.196 Cc1[n][nH]c2c(Cl)cccc21 Amb22371439 [0,1,0,1,0,0|1,0,1]=4 7416 B12R2.196 Cc1[n][nH]c2c(F)cccc21 Amb22751747 [0,1,0,1,0,0|1,0,1]=4 7417 B12R2.196 Cc1[n][nH]c2c(I)cccc21 Amb23402113 [0,1,0,1,0,0|1,0,1]=4 7418 B12R2.196 Cc1[n][nH]c2c(O)cccc21 Amb19958054 [0,1,0,1,0,0|1,0,1]=4 7419 B12R2.196 Cc1c[nH]c2c(Cl)cccc21 Amb18893518 [0,1,0,1,0,0|0,0,2]=4 7420 B12R2.196 Cc1c[nH]c2c(F)cccc21 Amb18243508 [0,1,0,1,0,0|0,0,2]=4 7421 B12R2.196 Cc1c[nH]c2c(I)cccc21 Amb24331788 [0,1,0,1,0,0|0,0,2]=4 7422 B12R2.196 Cc1c[nH]c2c(N)cccc21 Amb24067491 [0,1,0,1,0,0|0,0,2]=4 7423 B12R2.196 Cc1c[nH]c2c(O)cccc21 Amb24067492 [0,1,0,1,0,0|0,0,2]=4 7424 B12R2.196 Cc1c[n]cc2C(=C)CCc21 Amb24070547 [0,1,0,1,0,0|2,0,0]=4 7425 B12R2.196 Cc1cccc2C(=C)CCc21 Amb25071609 [0,1,0,1,0,0|1,0,0]=3 7426 B12R2.196 Cc1cccc2C(=O)CNc21 Amb18831418 [0,1,0,1,0,0|1,0,0]=3 7427 B12R2.196 Cc1cccc2C(=O)CSc21 Amb18199753 [0,1,0,1,0,0|2,0,0]=4 7428 B12R2.196 Cc1cccc2C(=O)NNc21 Amb22736794 [0,1,0,1,0,0|2,0,0]=4 7429 B12R2.196 Cc1cccc2c(Cl)[n][nH]c21 Amb23402114 [0,1,0,1,0,0|2,0,0]=4 7430 B12R2.196 Cc1cccc2c(Cl)c[nH]c21 Amb25194764 [0,1,0,1,0,0|1,0,1]=4 7431 B12R2.196 Cc1cccc2c(I)c[nH]c21 Amb23455968 [0,1,0,1,0,0|1,0,1]=4 7432 B12R2.196 Cc1cccc2c1[nH][n]c2C Amb23402115 [0,1,0,1,0,0|1,0,1]=4 7433 B12R2.196 Cc1cccc2c1[nH]cc2C Amb18243497 [0,1,0,1,0,0|0,0,2]=4 7434 B12R2.196 Clc1[n][nH]c2c(I)cccc21 Amb23402117 [0,1,0,1,0,0|2,0,0]=4 7435 B12R2.196 Clc1c[nH]c2c(Br)cccc21 Amb24067695 [0,1,0,1,0,0|1,0,1]=4 7436 B12R2.196 Clc1c[nH]c2c1cccc2N Amb10173480 [0,1,0,1,0,0|1,0,1]=4 7437 B12R2.196 Clc1cccc2c(Br)c[nH]c21 Amb20242678 [0,1,0,1,0,0|1,0,1]=4 7438 B12R2.196 Clc1cccc2c(I)c[nH]c21 Amb23455970 [0,1,0,1,0,0|1,0,1]=4 7439 B12R2.196 Clc1cccc2c1[nH][n]c2Cl Amb23402116 [0,1,0,1,0,0|2,0,0]=4 7440 B12R2.196 Clc1cccc2c1[nH]cc2Cl Amb24067564 [0,1,0,1,0,0|1,0,1]=4 7441 B12R2.196 Clc1cccc2c1[nH]nc2N Amb10975588 [0,1,0,1,0,0|2,0,0]=4 7442 B12R2.196 Fc1cccc2c(Br)[n][nH]c21 Amb19957732 [0,1,0,1,0,0|2,0,0]=4 7443 B12R2.196 Fc1cccc2c(Cl)[n][nH]c21 Amb22490665 [0,1,0,1,0,0|2,0,0]=4 7444 B12R2.196 Fc1cccc2c(I)[n][nH]c21 Amb21864876 [0,1,0,1,0,0|2,0,0]=4 7445 B12R2.196 Fc1cccc2c(I)c[nH]c21 Amb23455969 [0,1,0,1,0,0|1,0,1]=4 7446 B12R2.196 Nc1[n][nH]c2c(Br)cccc21 Amb19958179 [0,1,0,1,0,0|2,0,0]=4 7447 B12R2.196 Nc1[n][nH]c2c(F)cccc21 Amb22167218 [0,1,0,1,0,0|2,0,0]=4 7448 B12R2.196 Nc1c[nH]c2c(Br)cccc21 Amb18176121 [0,1,0,1,0,0|1,0,1]=4 7449 B12R2.196 Nc1cccc2C(=O)COc21 Amb18202194 [0,1,0,1,0,0|2,0,0]=4 7450 B12R2.196 Nc1cccc2C(=O)CSc21 Amb18199701 [0,1,0,1,0,0|2,0,0]=4 7451 B12R2.196 Nc1cccc2c(=O)[nH][nH]c21 Amb24082852 [0,1,0,1,0,0|2,0,0]=4 7452 B12R2.196 Nc1cccc2c(Br)c[nH]c21 Amb22754610 [0,1,0,1,0,0|1,0,1]=4 7453 B12R2.196 Nc1cccc2c(Cl)[n][nH]c21 Amb22750198 [0,1,0,1,0,0|2,0,0]=4 7454 B12R2.196 Nc1cccc2c(Cl)c[nH]c21 Amb24074008 [0,1,0,1,0,0|1,0,1]=4 7455 B12R2.196 Nc1cccc2c(I)c[nH]c21 Amb24067489 [0,1,0,1,0,0|1,0,1]=4 7456 B12R2.196 Nc1cccc2c1[nH]nc2C Amb1090850 [0,1,0,1,0,0|1,0,1]=4 7457 B12R2.196 O=C1CCc2c1cccc2Cl Amb2383535 [0,1,0,1,0,0|2,0,0]=4 7458 B12R2.196 O=C1CCc2c1cccc2F Amb2383536 [0,1,0,1,0,0|2,0,0]=4 7459 B12R2.196 O=C1CCc2c1cccc2I Amb10602518 [0,1,0,1,0,0|2,0,0]=4 7460 B12R2.196 O=C1CCc2c1cccc2N Amb10067615 [0,1,0,1,0,0|2,0,0]=4 7461 B12R2.196 O=C1CCc2c1cccc2O Amb1158068 [0,1,0,1,0,0|2,0,0]=4 7462 B12R2.196 O=C1CNc2c(F)cccc21 Amb18201774 [0,1,0,1,0,0|1,0,0]=3 7463 B12R2.196 O=C1COc2c1cccc2Cl Amb2383545 [0,1,0,1,0,0|2,0,0]=4 7464 B12R2.196 O=C1COc2c1cccc2F Amb2383546 [0,1,0,1,0,0|2,0,0]=4 7465 B12R2.196 O=C1CSc2c(Br)cccc21 Amb18159421 [0,1,0,1,0,0|2,0,0]=4 7466 B12R2.196 O=C1CSc2c(Cl)cccc21 Amb18822582 [0,1,0,1,0,0|2,0,0]=4 7467 B12R2.196 O=C1CSc2c(F)cccc21 Amb23597480 [0,1,0,1,0,0|2,0,0]=4 7468 B12R2.196 O=C1CSc2c(I)cccc21 Amb25248636 [0,1,0,1,0,0|2,0,0]=4 7469 B12R2.196 O=C1NNc2c(Br)cccc21 Amb22170435 [0,1,0,1,0,0|2,0,0]=4 7470 B12R2.196 O=C1NNc2c(F)cccc21 Amb22738649 [0,1,0,1,0,0|2,0,0]=4 7471 B12R2.196 Oc1c[nH]c2c(Cl)cccc21 Amb24067436 [0,1,0,1,0,0|1,0,1]=4 7472 B12R2.196 Oc1cccc2C(=O)COc21 Amb22490978 [0,1,0,1,0,0|2,0,0]=4 7473 B12R2.196 Oc1cccc2c(Br)[n][nH]c21 Amb22500545 [0,1,0,1,0,0|2,0,0]=4 7474 B12R2.196 Oc1cccc2c(Cl)[n][nH]c21 Amb22500544 [0,1,0,1,0,0|2,0,0]=4 7475 B12R2.196 Oc1cccc2c(I)[n][nH]c21 Amb24329196 [0,1,0,1,0,0|2,0,0]=4 7476 B12R2.225 Clc1ccccc1NC2CC2 Amb18267914 [0,1,0,1,0,0|0,0,2]=4 7477 B12R2.225 Fc1ccccc1NC2CC2 Amb18930891 [0,1,0,1,0,0|0,0,2]=4 7478 B12R2.225 Ic1ccccc1NC2CC2 Amb25213888 [0,1,0,1,0,0|0,0,2]=4 7479 B12R2.517 Brc1ccccc1N2CCC2 Amb25247790 [0,1,0,1,0,0|0,0,2]=4 7480 B12R2.517 Nc1ccccc1N2CCC2 Amb25824180 [0,1,0,1,0,0|0,0,2]=4 7481 B12R2.203 Brc1c[nH]c2cccc(Br)c12 Amb25791084 [0,1,0,1,0,0|1,0,1]=4 7482 B12R2.203 Brc1cccc2[nH]cc(I)c21 Amb25245182 [0,1,0,1,0,0|1,0,1]=4 7483 B12R2.203 Brc1cccc2c1c(C)n[nH]2 Amb10070861 [0,1,0,1,0,0|1,0,1]=4 7484 B12R2.203 Brc1cccc2c1c(N)n[nH]2 Amb10070571 [0,1,0,1,0,0|2,0,0]=4 7485 B12R2.203 CC1CNc2cccc(F)c21 Amb24596681 [0,1,0,1,0,0|0,0,2]=4 7486 B12R2.203 CC1CNc2cccc(O)c21 Amb18124995 [0,1,0,1,0,0|0,0,2]=4 7487 B12R2.203 Cc1[n][nH]c2cccc(Cl)c21 Amb21963076 [0,1,0,1,0,0|1,0,1]=4 7488 B12R2.203 Cc1[n][nH]c2cccc(I)c21 Amb23402118 [0,1,0,1,0,0|1,0,1]=4 7489 B12R2.203 Cc1[n][nH]c2cccc(N)c21 Amb24533070 [0,1,0,1,0,0|1,0,1]=4 7490 B12R2.203 Cc1c[nH]c2cccc(Br)c21 Amb21856939 [0,1,0,1,0,0|0,0,2]=4 7491 B12R2.203 Cc1c[nH]c2cccc(C)c12 Amb24331786 [0,1,0,1,0,0|0,0,2]=4 7492 B12R2.203 Cc1c[nH]c2cccc(Cl)c21 Amb24331785 [0,1,0,1,0,0|0,0,2]=4 7493 B12R2.203 Cc1c[nH]c2cccc(F)c21 Amb25339434 [0,1,0,1,0,0|0,0,2]=4 7494 B12R2.203 Cc1c[nH]c2cccc(I)c21 Amb24331784 [0,1,0,1,0,0|0,0,2]=4 7495 B12R2.203 Cc1c[nH]c2cccc(N)c21 Amb23439613 [0,1,0,1,0,0|0,0,2]=4 7496 B12R2.203 Cc1cccc2NNC(=N)c21 Amb24413143 [0,1,0,1,0,0|2,0,0]=4 7497 B12R2.203 Cc1cccc2OCC(=O)c21 Amb18202264 [0,1,0,1,0,0|2,0,0]=4 7498 B12R2.203 Cc1cccc2SCC(=O)c21 Amb18199755 [0,1,0,1,0,0|2,0,0]=4 7499 B12R2.203 Cc1cccc2[nH][n]c(Br)c21 Amb22494582 [0,1,0,1,0,0|2,0,0]=4 7500 B12R2.203 Cc1cccc2[nH][n]c(C)c12 Amb25775275 [0,1,0,1,0,0|1,0,1]=4 7501 B12R2.203 Cc1cccc2[nH][n]c(Cl)c21 Amb24648703 [0,1,0,1,0,0|2,0,0]=4 7502 B12R2.203 Cc1cccc2[nH]cc(Cl)c21 Amb24487993 [0,1,0,1,0,0|1,0,1]=4 7503 B12R2.203 Clc1[n][nH]c2cccc(I)c21 Amb23402122 [0,1,0,1,0,0|2,0,0]=4 7504 B12R2.203 Clc1c[nH]c2cccc(Br)c21 Amb24558339 [0,1,0,1,0,0|1,0,1]=4 7505 B12R2.203 Clc1cccc2[nH][n]c(Cl)c12 Amb23402121 [0,1,0,1,0,0|2,0,0]=4 7506 B12R2.203 Clc1cccc2[nH]cc(I)c21 Amb24681754 [0,1,0,1,0,0|1,0,1]=4 7507 B12R2.203 Clc1cccc2c1c(Br)c[nH]2 Amb17134440 [0,1,0,1,0,0|1,0,1]=4 7508 B12R2.203 Fc1cccc2[nH]cc(Br)c21 Amb25824009 [0,1,0,1,0,0|1,0,1]=4 7509 B12R2.203 Fc1cccc2c1c(N)n[nH]2 Amb1072364 [0,1,0,1,0,0|2,0,0]=4 7510 B12R2.203 Ic1cccc2c1c(N)n[nH]2 Amb10069981 [0,1,0,1,0,0|2,0,0]=4 7511 B12R2.203 Nc1[n][nH]c2cccc(O)c21 Amb21963155 [0,1,0,1,0,0|2,0,0]=4 7512 B12R2.203 Nc1c[nH]c2cccc(Cl)c21 Amb18199548 [0,1,0,1,0,0|1,0,1]=4 7513 B12R2.203 Nc1c[nH]c2cccc(F)c21 Amb18201968 [0,1,0,1,0,0|1,0,1]=4 7514 B12R2.203 Nc1cccc2[nH][n]c(O)c21 Amb22756033 [0,1,0,1,0,0|2,0,0]=4 7515 B12R2.203 Nc1cccc2[nH]cc(Br)c21 Amb23571448 [0,1,0,1,0,0|1,0,1]=4 7516 B12R2.203 Nc1cccc2[nH]cc(Cl)c21 Amb23571447 [0,1,0,1,0,0|1,0,1]=4 7517 B12R2.203 Nc1cccc2[nH]cc(I)c21 Amb24367635 [0,1,0,1,0,0|1,0,1]=4 7518 B12R2.203 O=C1CCc2c1c(Br)ccc2 Amb16232616 [0,1,0,1,0,0|2,0,0]=4 7519 B12R2.203 O=C1CCc2c1c(C)ccc2 Amb16232631 [0,1,0,1,0,0|2,0,0]=4 7520 B12R2.203 O=C1CCc2c1c(F)ccc2 Amb10603926 [0,1,0,1,0,0|2,0,0]=4 7521 B12R2.203 O=C1CCc2c1c(I)ccc2 Amb10602520 [0,1,0,1,0,0|2,0,0]=4 7522 B12R2.203 O=C1CCc2c1c(N)ccc2 Amb10603890 [0,1,0,1,0,0|2,0,0]=4 7523 B12R2.203 O=C1COc2c1c(Br)ccc2 Amb16233082 [0,1,0,1,0,0|2,0,0]=4 7524 B12R2.203 O=C1COc2c1c(F)ccc2 Amb10840768 [0,1,0,1,0,0|2,0,0]=4 7525 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,1,0,0|2,0,0]=4 7526 B12R2.203 O=C1COc2cccc(I)c21 Amb21964893 [0,1,0,1,0,0|2,0,0]=4 7527 B12R2.203 O=C1CSc2cccc(Br)c21 Amb24757029 [0,1,0,1,0,0|2,0,0]=4 7528 B12R2.203 O=C1CSc2cccc(Cl)c21 Amb18822610 [0,1,0,1,0,0|2,0,0]=4 7529 B12R2.203 O=C1NNc2cccc(Br)c21 Amb22497381 [0,1,0,1,0,0|2,0,0]=4 7530 B12R2.203 O=C1NNc2cccc(Cl)c21 Amb19373186 [0,1,0,1,0,0|2,0,0]=4 7531 B12R2.203 O=C1NNc2cccc(F)c21 Amb19665848 [0,1,0,1,0,0|2,0,0]=4 7532 B12R2.203 Oc1cccc2OCC(=O)c21 Amb18125055 [0,1,0,1,0,0|2,0,0]=4 7533 B12R2.203 Oc1cccc2[nH][n]c(Br)c21 Amb22501115 [0,1,0,1,0,0|2,0,0]=4 7534 B12R2.203 Oc1cccc2[nH][n]c(Cl)c21 Amb22501116 [0,1,0,1,0,0|2,0,0]=4 7535 B12R2.203 Oc1cccc2[nH][n]c(F)c21 Amb24334706 [0,1,0,1,0,0|2,0,0]=4 7536 B12R2.203 Oc1cccc2[nH][n]c(I)c21 Amb22501106 [0,1,0,1,0,0|2,0,0]=4 7537 B12R2.203 Oc1cccc2[nH]cc(Cl)c21 Amb24665689 [0,1,0,1,0,0|1,0,1]=4 7538 B12R2.203 Sc1c[nH]c2cccc(Cl)c21 Amb25309748 [0,1,0,1,0,0|1,0,1]=4 7539 B12R2.612 Brc1cc2[nH]cc(I)c2cc1 Amb24067643 [0,1,0,1,0,0|1,0,1]=4 7540 B12R2.612 Brc1ccc2c(c1)OCC2=O Amb10070946 [0,1,0,1,0,0|2,0,0]=4 7541 B12R2.612 Brc1ccc2c(c1)[nH]cc2Br Amb15691709 [0,1,0,1,0,0|1,0,1]=4 7542 B12R2.612 C=C1CCc2cc(Br)ccc21 Amb22229945 [0,1,0,1,0,0|1,0,0]=3 7543 B12R2.612 C=C1CCc2cc(Cl)ccc21 Amb24369315 [0,1,0,1,0,0|1,0,0]=3 7544 B12R2.612 C=C1CCc2cc(F)ccc21 Amb24411882 [0,1,0,1,0,0|1,0,0]=3 7545 B12R2.612 C=C1CCc2cc(N)ccc21 Amb25837088 [0,1,0,1,0,0|1,0,0]=3 7546 B12R2.612 CC1CNc2cc(Br)ccc21 Amb25103823 [0,1,0,1,0,0|0,0,2]=4 7547 B12R2.612 CC1CNc2cc(O)ccc21 Amb24401085 [0,1,0,1,0,0|0,0,2]=4 7548 B12R2.612 CN1CNc2cc(Cl)ccc12 Amb25047689 [0,1,0,1,0,0|1,0,1]=4 7549 B12R2.612 CN1CNc2cc(F)ccc12 Amb24592119 [0,1,0,1,0,0|1,0,1]=4 7550 B12R2.612 Cc1[n][nH]c2cc(F)ccc21 Amb20241224 [0,1,0,1,0,0|1,0,1]=4 7551 B12R2.612 Cc1[n][nH]c2cc(I)ccc21 Amb22406188 [0,1,0,1,0,0|1,0,1]=4 7552 B12R2.612 Cc1[n][nH]c2cc(N)ccc21 Amb20241440 [0,1,0,1,0,0|1,0,1]=4 7553 B12R2.612 Cc1c[nH]c2cc(Br)ccc21 Amb21964696 [0,1,0,1,0,0|0,0,2]=4 7554 B12R2.612 Cc1c[nH]c2cc(Cl)ccc21 Amb18893519 [0,1,0,1,0,0|0,0,2]=4 7555 B12R2.612 Cc1c[nH]c2cc(F)ccc21 Amb18243509 [0,1,0,1,0,0|0,0,2]=4 7556 B12R2.612 Cc1c[nH]c2cc(I)ccc21 Amb24331789 [0,1,0,1,0,0|0,0,2]=4 7557 B12R2.612 Cc1c[nH]c2cc(N)ccc21 Amb18202358 [0,1,0,1,0,0|0,0,2]=4 7558 B12R2.612 Cc1c[nH]c2cc(O)ccc21 Amb18124816 [0,1,0,1,0,0|0,0,2]=4 7559 B12R2.612 Cc1cc2CCC(=S)c2cc1 Amb25151236 [0,1,0,1,0,0|2,0,0]=4 7560 B12R2.612 Cc1cc2OCC(=O)c2cc1 Amb18202265 [0,1,0,1,0,0|2,0,0]=4 7561 B12R2.612 Cc1cc2SCC(=O)c2cc1 Amb18199754 [0,1,0,1,0,0|2,0,0]=4 7562 B12R2.612 Cc1cc2[nH][n]c(C)c2cc1 Amb22493908 [0,1,0,1,0,0|1,0,1]=4 7563 B12R2.612 Cc1cc2[nH][n]c(Cl)c2cc1 Amb22754307 [0,1,0,1,0,0|2,0,0]=4 7564 B12R2.612 Cc1cc2[nH][n]c(N)c2cc1 Amb22057527 [0,1,0,1,0,0|2,0,0]=4 7565 B12R2.612 Cc1cc2[nH]cc(C)c2cc1 Amb18243498 [0,1,0,1,0,0|0,0,2]=4 7566 B12R2.612 Cc1cc2[nH]cc(Cl)c2cc1 Amb24472955 [0,1,0,1,0,0|1,0,1]=4 7567 B12R2.612 Cc1cc2[nH]cc(I)c2cc1 Amb25114128 [0,1,0,1,0,0|1,0,1]=4 7568 B12R2.612 Cc1cc2[nH]cc(N)c2cc1 Amb18202357 [0,1,0,1,0,0|1,0,1]=4 7569 B12R2.612 Cc1ccc2c(c1)NCN2C Amb25148182 [0,1,0,1,0,0|1,0,1]=4 7570 B12R2.612 Clc1c[nH]c2cc(Br)ccc21 Amb18160712 [0,1,0,1,0,0|1,0,1]=4 7571 B12R2.612 Clc1cc2[nH]cc(Cl)c2cc1 Amb25831108 [0,1,0,1,0,0|1,0,1]=4 7572 B12R2.612 Clc1ccc2c(c1)OCC2=O Amb10070947 [0,1,0,1,0,0|2,0,0]=4 7573 B12R2.612 Fc1cc2[nH][n]c(Cl)c2cc1 Amb22497972 [0,1,0,1,0,0|2,0,0]=4 7574 B12R2.612 Fc1cc2[nH]cc(I)c2cc1 Amb24067652 [0,1,0,1,0,0|1,0,1]=4 7575 B12R2.612 Fc1ccc2c(c1)OCC2=O Amb10840769 [0,1,0,1,0,0|2,0,0]=4 7576 B12R2.612 Ic1ccc2c(c1)CCC2=O Amb10602519 [0,1,0,1,0,0|2,0,0]=4 7577 B12R2.612 Ic1ccc2c(c1)OCC2=O Amb16233079 [0,1,0,1,0,0|2,0,0]=4 7578 B12R2.612 NC1CNc2cc(Br)ccc21 Amb25311429 [0,1,0,1,0,0|1,0,1]=4 7579 B12R2.612 NC=1NNC2=CC(=N)C=CC21 Amb24392472 [0,1,0,1,0,0|2,0,0]=4 7580 B12R2.612 Nc1[n][nH]c2cc(I)ccc21 Amb22371239 [0,1,0,1,0,0|2,0,0]=4 7581 B12R2.612 Nc1c[nH]c2cc(Br)ccc21 Amb18176120 [0,1,0,1,0,0|1,0,1]=4 7582 B12R2.612 Nc1c[nH]c2cc(Cl)ccc21 Amb18199549 [0,1,0,1,0,0|1,0,1]=4 7583 B12R2.612 Nc1c[nH]c2cc(Cl)ccc21 Amb24117873 [0,1,0,1,0,0|1,0,1]=4 7584 B12R2.612 Nc1c[nH]c2cc(F)ccc21 Amb18201966 [0,1,0,1,0,0|1,0,1]=4 7585 B12R2.612 Nc1c[nH]c2cc(O)ccc21 Amb18202248 [0,1,0,1,0,0|1,0,1]=4 7586 B12R2.612 Nc1cc2NNC(=O)c2cc1 Amb21964765 [0,1,0,1,0,0|2,0,0]=4 7587 B12R2.612 Nc1cc2NNC(=O)c2cc1 Amb22008653 [0,1,0,1,0,0|2,0,0]=4 7588 B12R2.612 Nc1cc2[nH][n]c(N)c2cc1 Amb20623686 [0,1,0,1,0,0|2,0,0]=4 7589 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,1,0,0|2,0,0]=4 7590 B12R2.612 Nc1n[nH]c2cc(F)ccc12 Amb17935866 [0,1,0,1,0,0|2,0,0]=4 7591 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,1,0,0|2,0,0]=4 7592 B12R2.612 O=C1CNc2cc(Cl)ccc21 Amb24082868 [0,1,0,1,0,0|1,0,0]=3 7593 B12R2.612 O=C1NNc2cc(Cl)ccc21 Amb22491677 [0,1,0,1,0,0|2,0,0]=4 7594 B12R2.612 O=C1NNc2cc(F)ccc21 Amb21864861 [0,1,0,1,0,0|2,0,0]=4 7595 B12R2.612 O=C1ONc2cc(Br)ccc21 Amb25828949 [0,1,0,1,0,0|2,0,0]=4 7596 B12R2.612 Oc1c[nH]c2cc(Br)ccc21 Amb22001897 [0,1,0,1,0,0|1,0,1]=4 7597 B12R2.612 Oc1c[nH]c2cc(Cl)ccc21 Amb24067431 [0,1,0,1,0,0|1,0,1]=4 7598 B12R2.612 Oc1c[nH]c2cc(F)ccc21 Amb25143984 [0,1,0,1,0,0|1,0,1]=4 7599 B12R2.612 Oc1cc2[nH][n]c(Br)c2cc1 Amb22501110 [0,1,0,1,0,0|2,0,0]=4 7600 B12R2.612 Oc1cc2[nH][n]c(I)c2cc1 Amb22501119 [0,1,0,1,0,0|2,0,0]=4 7601 B12R2.612 Oc1cc2[nH]cc(Cl)c2cc1 Amb24708306 [0,1,0,1,0,0|1,0,1]=4 7602 B12R2.612 Oc1ccc2c(c1)OCC2=O Amb1155533 [0,1,0,1,0,0|2,0,0]=4 7603 B12R2.612 Oc1ccc2c(c1)[nH]nc2C Amb15692235 [0,1,0,1,0,0|1,0,1]=4 7604 B12R2.612 S=C1CCc2cc(Br)ccc21 Amb24361326 [0,1,0,1,0,0|2,0,0]=4 7605 B12R2.612 Sc1cc2[nH][n]c(Br)c2cc1 Amb25094497 [0,1,0,1,0,0|2,0,0]=4 7606 B12R2.1286 Brc1cc(ccc1)NC2CC2 Amb24622562 [0,1,0,1,0,0|0,0,2]=4 7607 B12R2.1286 Cc1cc(ccc1)NC2CC2 Amb25068491 [0,1,0,1,0,0|0,0,2]=4 7608 B12R2.1286 Clc1cc(ccc1)NC2CC2 Amb18930890 [0,1,0,1,0,0|0,0,2]=4 7609 B12R2.1286 Fc1cc(ccc1)NC2CC2 Amb18270328 [0,1,0,1,0,0|0,0,2]=4 7610 B12R2.1286 Oc1cc(ccc1)NC2CC2 Amb24464849 [0,1,0,1,0,0|0,0,2]=4 7611 B12R2.2313 Brc1cc(ccc1)C=2CCC2 Amb24707396 [0,1,0,1,0,0|1,0,1]=4 7612 B12R2.1 BrCc1[n][nH]c2ccccc21 Amb22263673 [0,1,0,1,0,0|1,0,1]=4 7613 B12R2.1 BrCc1c[nH]c2ccccc12 Amb17689304 [0,1,0,1,0,0|0,0,2]=4 7614 B12R2.1 C#Cc1[n][nH]c2ccccc21 Amb25122242 [0,1,0,1,0,0|1,0,1]=4 7615 B12R2.1 C#Cc1c[nH]c2ccccc21 Amb22496990 [0,1,0,1,0,0|0,0,2]=4 7616 B12R2.1 C=CC1CNc2ccccc21 Amb24486031 [0,1,0,1,0,0|0,0,0]=2 7617 B12R2.1 C=C[n]1[n]cc2ccccc12 Amb24648750 [0,1,0,1,0,0|1,0,1]=4 7618 B12R2.1 C=C[n]1c[n]c2ccccc12 Amb20647962 [0,1,0,1,0,0|0,0,2]=4 7619 B12R2.1 C=C[n]1ccc2ccccc12 Amb25678621 [0,1,0,1,0,0|1,0,1]=4 7620 B12R2.1 C=Cc1[n][nH]c2ccccc21 Amb25844526 [0,1,0,1,0,0|0,0,1]=3 7621 B12R2.1 C=Cc1[n][s]c2ccccc21 Amb24566532 [0,1,0,1,0,0|0,0,2]=4 7622 B12R2.1 C=Cc1c[nH]c2c1cccn2 Amb13885251 [0,1,0,1,0,0|1,0,1]=4 7623 B12R2.1 C=Cn1cnc2c1cccc2 Amb1035881 [0,1,0,1,0,0|0,0,2]=4 7624 B12R2.1 C=Cn1nnc2c1cccc2 Amb10559409 [0,1,0,1,0,0|1,0,1]=4 7625 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|0,0,2]=4 7626 B12R2.1 CCN1CNc2ccccc12 Amb24064698 [0,1,0,1,0,0|0,0,2]=4 7627 B12R2.1 CCc1[n][nH]c2ccccc21 Amb22304738 [0,1,0,1,0,0|1,0,1]=4 7628 B12R2.1 CNc1[n][nH]c2ccccc12 Amb24373595 [0,1,0,1,0,0|1,0,1]=4 7629 B12R2.1 CNc1c[nH]c2ccccc12 Amb18553874 [0,1,0,1,0,0|0,0,2]=4 7630 B12R2.1 COc1[n][nH]c2ccccc21 Amb21857106 [0,1,0,1,0,0|1,0,1]=4 7631 B12R2.1 COc1c[nH]c2ccccc12 Amb22489959 [0,1,0,1,0,0|0,0,2]=4 7632 B12R2.1 CSc1[n][nH]c2ccccc21 Amb22277104 [0,1,0,1,0,0|1,0,1]=4 7633 B12R2.1 C\C=C/1\C=Cc2ccccc21 Amb25322411 [0,1,0,1,0,0|1,0,1]=4 7634 B12R2.1 C\C=C\1/CNc2ccccc21 Amb25858232 [0,1,0,1,0,0|0,0,0]=2 7635 B12R2.1 ClCc1c[nH]c2ccccc21 Amb18862655 [0,1,0,1,0,0|0,0,2]=4 7636 B12R2.1 Cl[Hg]c1c[nH]c2ccccc12 Amb24184824 [0,1,0,1,0,0|1,0,1]=4 7637 B12R2.1 Cl\C=C/1\CCc2ccccc21 Amb24519209 [0,1,0,1,0,0|1,0,0]=3 7638 B12R2.1 FCC1CNc2ccccc21 Amb25178926 [0,1,0,1,0,0|0,0,2]=4 7639 B12R2.1 FCc1c[nH]c2ccccc21 Amb24574383 [0,1,0,1,0,0|0,0,2]=4 7640 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|0,0,2]=4 7641 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|0,0,2]=4 7642 B12R2.1 NCc1c[nH]c2c1cccc2 Amb17603142 [0,1,0,1,0,0|0,0,2]=4 7643 B12R2.1 NCc1c[nH]c2ccccc12 Amb17760648 [0,1,0,1,0,0|0,0,2]=4 7644 B12R2.1 NCc1c[nH]c2ccccc12 Amb17844951 [0,1,0,1,0,0|0,0,2]=4 7645 B12R2.1 NCc1n[nH]c2c1cccc2 Amb10602158 [0,1,0,1,0,0|1,0,1]=4 7646 B12R2.1 NCc1n[nH]c2ccccc12 Amb17739897 [0,1,0,1,0,0|1,0,1]=4 7647 B12R2.1 NNc1[n][nH]c2ccccc12 Amb24656596 [0,1,0,1,0,0|2,0,0]=4 7648 B12R2.1 NNc1c[nH]c2ccccc12 Amb25113889 [0,1,0,1,0,0|1,0,1]=4 7649 B12R2.1 N\N=C/1\CCc2c1cccc2 Amb2384463 [0,1,0,1,0,0|2,0,0]=4 7650 B12R2.1 O=CC1=CCc2ccccc12 Amb18644151 [0,1,0,1,0,0|1,0,1]=4 7651 B12R2.1 O=CC1C=Cc2ccccc21 Amb18644152 [0,1,0,1,0,0|2,0,0]=4 7652 B12R2.1 O=CC1C=Nc2ccccc21 Amb21952746 [0,1,0,1,0,0|1,0,1]=4 7653 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|1,0,1]=4 7654 B12R2.1 O=CC1CNc2ccccc21 Amb23590098 [0,1,0,1,0,0|0,0,1]=3 7655 B12R2.1 O=CC1COc2ccccc21 Amb23586276 [0,1,0,1,0,0|1,0,1]=4 7656 B12R2.1 O=C[C@H]1C=Cc2ccccc21 Amb25289156 [0,1,0,1,0,0|2,0,0]=4 7657 B12R2.1 O=Cc1[n][nH]c2[n]cccc21 Amb18831427 [0,1,0,1,0,0|2,0,0]=4 7658 B12R2.1 O=Cc1[n][nH]c2c[n]ccc21 Amb24330753 [0,1,0,1,0,0|2,0,0]=4 7659 B12R2.1 O=Cc1[n][nH]c2cc[n]cc21 Amb18202326 [0,1,0,1,0,0|2,0,0]=4 7660 B12R2.1 O=Cc1[n][nH]c2ccc[n]c21 Amb18202324 [0,1,0,1,0,0|2,0,0]=4 7661 B12R2.1 O=Cc1[n][s]c2ccccc21 Amb18645862 [0,1,0,1,0,0|2,0,0]=4 7662 B12R2.1 O=Cc1[n]oc2ccccc21 Amb18124808 [0,1,0,1,0,0|2,0,0]=4 7663 B12R2.1 O=Cc1[s]cc2ccccc21 Amb25134071 [0,1,0,1,0,0|2,0,0]=4 7664 B12R2.1 O=Cc1c[n-]c2ccccc21 Amb22751036 [0,1,0,1,0,0|0,0,2]=4 7665 B12R2.1 O=Cc1c[nH]c2c1cccc2 Amb1147114 [0,1,0,1,0,0|0,0,1]=3 7666 B12R2.1 O=Cc1c[nH]c2c1ccnc2 Amb16232293 [0,1,0,1,0,0|1,0,1]=4 7667 B12R2.1 O=Cc1c[nH]c2c1nccc2 Amb16232292 [0,1,0,1,0,0|1,0,1]=4 7668 B12R2.1 O=Cc1coc2c1cccc2 Amb10844786 [0,1,0,1,0,0|1,0,1]=4 7669 B12R2.1 O=Cc1csc2c1cccc2 Amb1157901 [0,1,0,1,0,0|1,0,1]=4 7670 B12R2.1 O=Cc1n[nH]c2ccccc12 Amb17739794 [0,1,0,1,0,0|1,0,0]=3 7671 B12R2.1 O=Cc1o[n]c2ccccc21 Amb18831437 [0,1,0,1,0,0|1,0,1]=4 7672 B12R2.1 O=Nc1c[nH]c2ccccc12 Amb17940483 [0,1,0,1,0,0|1,0,1]=4 7673 B12R2.1 O=[13CH]c1c[nH]c2c1cccc2 Amb17616072 [0,1,0,1,0,0|0,0,1]=3 7674 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|0,0,2]=4 7675 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|1,0,1]=4 7676 B12R2.1 OCc1c[nH]c2c1cccc2 Amb1153804 [0,1,0,1,0,0|0,0,2]=4 7677 B12R2.1 OCc1c[nH]c2c1cccc2 Amb16231311 [0,1,0,1,0,0|0,0,2]=4 7678 B12R2.1 OCc1n[nH]c2c1cccc2 Amb1070698 [0,1,0,1,0,0|1,0,1]=4 7679 B12R2.1 O\N=C/1\CCc2ccccc21 Amb24121339 [0,1,0,1,0,0|2,0,0]=4 7680 B12R2.1 O\N=C/1\CSc2ccccc21 Amb24611046 [0,1,0,1,0,0|2,0,0]=4 7681 B12R2.1 O\N=C\1/CCc2ccccc21 Amb22731286 [0,1,0,1,0,0|2,0,0]=4 7682 B12R2.1 O\N=C\1/COc2ccccc21 Amb19650724 [0,1,0,1,0,0|2,0,0]=4 7683 B12R2.1 [C-]#[N+]c1c[nH]c2ccccc12 Amb25233057 [0,1,0,1,0,0|0,0,2]=4 7684 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,1,0,0|0,0,2]=4 7685 B12R2.11 C[C@H]1C[C@@H]1Nc2ccccc2 Amb24581235 [0,1,0,1,0,0|0,0,2]=4 7686 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,1,0,0|0,0,2]=4 7687 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|1,0,1]=4 7688 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|0,0,1]=3 7689 B12R2.23 O=C1CN=C1c2ccccc2 Amb25151517 [0,1,0,1,0,0|1,0,1]=4 7690 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,1,0,1,0,0|1,0,0]=3 7691 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|2,0,0]=4 7692 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,1]=4 7693 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,1,0,0|0,0,1]=3 7694 B12R2.2057 C(NC1CC1)c2ccccc2 Amb19515725 [0,1,0,1,0,0|0,0,2]=4 7695 B12R2.2057 C(Nc1ccccc1)C2CC2 Amb22586372 [0,1,0,1,0,0|0,0,2]=4 7696 B12R2.2057 C1C=C1CNc2ccccc2 Amb25824311 [0,1,0,1,0,0|0,0,0]=2 7697 B12R2.2057 C1CC1CNc2ccccc2 Amb2383311 [0,1,0,1,0,0|0,0,2]=4 7698 B12R2.2058 C1CCC1Nc2ccccc2 Amb18283820 [0,1,0,1,0,0|0,0,2]=4 7699 B12R2.2058 C1N=CN1Cc2ccccc2 Amb25709568 [0,1,0,1,0,0|1,0,0]=3 7700 B12R2.2058 C1OCC1Nc2ccccc2 Amb22737358 [0,1,0,1,0,0|0,0,2]=4 7701 B12R2.2058 C1SCC1Nc2ccccc2 Amb25362257 [0,1,0,1,0,0|0,0,2]=4 7702 B12R2.18 Brc1[nH]c2c(c1C)cccc2 Amb17595638 [0,1,0,1,0,0|0,0,2]=4 7703 B12R2.18 Brc1[nH]c2ccccc2c1Br Amb17672709 [0,1,0,1,0,0|1,0,1]=4 7704 B12R2.18 Brc1c(I)[nH]c2ccccc21 Amb24627969 [0,1,0,1,0,0|1,0,1]=4 7705 B12R2.18 C=C1C(=O)Nc2ccccc12 Amb17779246 [0,1,0,1,0,0|0,0,1]=3 7706 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [0,1,0,1,0,0|1,0,0]=3 7707 B12R2.18 CC1C(C)Nc2c1cccc2 Amb17593676 [0,1,0,1,0,0|0,0,2]=4 7708 B12R2.18 CC1Nc2ccccc2N1Cl Amb25095932 [0,1,0,1,0,0|2,0,0]=4 7709 B12R2.18 CC1Sc2ccccc2C1=O Amb25032373 [0,1,0,1,0,0|2,0,0]=4 7710 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [0,1,0,1,0,0|2,0,0]=4 7711 B12R2.18 C[C@H]1Nc2ccccc2[C@@H]1O Amb24629727 [0,1,0,1,0,0|1,0,1]=4 7712 B12R2.18 C[n]1[nH]c2ccccc2c1=O Amb24102205 [0,1,0,1,0,0|2,0,0]=4 7713 B12R2.18 Cc1[nH]c2c(c1C)cccc2 Amb1205252 [0,1,0,1,0,0|0,0,2]=4 7714 B12R2.18 Cc1[nH]c2c(c1I)cccc2 Amb17134452 [0,1,0,1,0,0|1,0,1]=4 7715 B12R2.18 Cc1[nH]c2ccccc2c1Cl Amb17673944 [0,1,0,1,0,0|1,0,1]=4 7716 B12R2.18 Cc1[nH]c2ccccc2c1F Amb24120604 [0,1,0,1,0,0|1,0,1]=4 7717 B12R2.18 Cc1[nH]c2ccccc2c1S Amb25119252 [0,1,0,1,0,0|1,0,1]=4 7718 B12R2.18 Cc1c(Cl)[nH]c2ccccc21 Amb23441609 [0,1,0,1,0,0|0,0,2]=4 7719 B12R2.18 Cc1c(F)[nH]c2ccccc21 Amb24679317 [0,1,0,1,0,0|0,0,2]=4 7720 B12R2.18 Cc1c(I)[nH]c2ccccc21 Amb24067551 [0,1,0,1,0,0|0,0,2]=4 7721 B12R2.18 Cc1c(O)[nH]c2ccccc21 Amb25709196 [0,1,0,1,0,0|0,0,2]=4 7722 B12R2.18 Clc1[nH]c2ccccc2c1Br Amb24586578 [0,1,0,1,0,0|1,0,1]=4 7723 B12R2.18 Clc1c2ccccc2[nH]c1Cl Amb22263103 [0,1,0,1,0,0|1,0,1]=4 7724 B12R2.18 Ic1c2ccccc2[nH]c1I Amb25790468 [0,1,0,1,0,0|1,0,1]=4 7725 B12R2.18 NC1C(O)Nc2ccccc21 Amb25722216 [0,1,0,1,0,0|1,0,1]=4 7726 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [0,1,0,1,0,0|2,0,0]=4 7727 B12R2.18 NC1Oc2ccccc2C1=O Amb24349623 [0,1,0,1,0,0|2,0,0]=4 7728 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [0,1,0,1,0,0|2,0,0]=4 7729 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [0,1,0,1,0,0|2,0,0]=4 7730 B12R2.18 O=C1C(=S)Nc2c1cccc2 Amb17594053 [0,1,0,1,0,0|1,0,1]=4 7731 B12R2.18 O=C1C(Br)Oc2ccccc21 Amb25835380 [0,1,0,1,0,0|2,0,0]=4 7732 B12R2.18 O=C1C(C)Nc2c1cccc2 Amb17593674 [0,1,0,1,0,0|1,0,0]=3 7733 B12R2.18 O=C1C(Cl)Nc2ccccc21 Amb25059201 [0,1,0,1,0,0|1,0,0]=3 7734 B12R2.18 O=C1C(Cl)Oc2ccccc21 Amb24061516 [0,1,0,1,0,0|2,0,0]=4 7735 B12R2.18 O=C1C(Cl)Sc2ccccc21 Amb24533113 [0,1,0,1,0,0|2,0,0]=4 7736 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [0,1,0,1,0,0|2,0,0]=4 7737 B12R2.18 O=C1C(F)Sc2ccccc21 Amb24690556 [0,1,0,1,0,0|2,0,0]=4 7738 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [0,1,0,1,0,0|2,0,0]=4 7739 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [0,1,0,1,0,0|2,0,0]=4 7740 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [0,1,0,1,0,0|2,0,0]=4 7741 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [0,1,0,1,0,0|2,0,0]=4 7742 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [0,1,0,1,0,0|2,0,0]=4 7743 B12R2.18 OC1Nc2ccccc2C1O Amb24090494 [0,1,0,1,0,0|1,0,1]=4 7744 B12R2.18 OC1Oc2ccccc2C1=O Amb24061518 [0,1,0,1,0,0|2,0,0]=4 7745 B12R2.18 ON1Nc2ccccc2C1=O Amb24078896 [0,1,0,1,0,0|2,0,0]=4 7746 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [0,1,0,1,0,0|2,0,0]=4 7747 B12R2.18 Oc1c(S)[nH]c2ccccc21 Amb24085063 [0,1,0,1,0,0|1,0,1]=4 7748 B12R2.2051 CC1(Cc2ccccc12)C=C Amb17778871 [0,1,0,1,0,0|1,0,0]=3 7749 B12R2.2403 CC1(C)CNc2c1cccc2 Amb17232031 [0,1,0,1,0,0|0,0,2]=4 7750 B12R2.2403 CC1(C)CNc2ccccc12 Amb20630653 [0,1,0,1,0,0|0,0,2]=4 7751 B12R2.2403 OC1(Br)CNc2ccccc12 Amb25195439 [0,1,0,1,0,0|1,0,1]=4 7752 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [0,1,0,1,0,0|2,0,0]=4 7753 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,1,0,1,0,0|2,0,0]=4 7754 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [0,1,0,1,0,0|2,0,0]=4 7755 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,1,0,1,0,0|2,0,0]=4 7756 B12R3.1625 C1c2ccc3C1=COC[n]23 Amb24100931 [0,0,0,2,0,0|1,0,1]=4 7757 B8R1.8 C=CCc1[nH]cc[n]1 Amb22733979 [1,0,0,0,1,0|2,0,0]=4 7758 B8R1.8 C=CCc1c[nH]cc1 Amb24426386 [1,0,0,0,1,0|1,0,0]=3 7759 B8R1.8 C=CCc1c[s]c[n]1 Amb24737039 [1,0,0,0,1,0|2,0,0]=4 7760 B8R1.8 C=CCc1cc[nH][n]1 Amb24353819 [1,0,0,0,1,0|2,0,0]=4 7761 B8R1.8 C=CCc1cc[s][n]1 Amb25804826 [1,0,0,0,1,0|2,0,0]=4 7762 B8R1.8 C=CCc1ccc[nH]1 Amb25075519 [1,0,0,0,1,0|1,0,0]=3 7763 B8R1.8 C=CCc1cocc1 Amb24729373 [1,0,0,0,1,0|1,0,0]=3 7764 B8R1.8 C=CNc1ccco1 Amb24516221 [1,0,0,0,1,0|1,0,0]=3 7765 B8R1.8 C=CSc1ccc[nH]1 Amb24481497 [1,0,0,0,1,0|2,0,0]=4 7766 B8R1.8 CCN[n]1cccc1 Amb25277204 [1,0,0,0,1,0|1,0,1]=4 7767 B8R1.8 CCNc1c[nH]cc1 Amb25717948 [1,0,0,0,1,0|1,0,1]=4 7768 B8R1.8 CCNc1c[s]cc1 Amb25743947 [1,0,0,0,1,0|1,0,1]=4 7769 B8R1.8 CCNc1ccc[s]1 Amb18055004 [1,0,0,0,1,0|1,0,1]=4 7770 B8R1.8 O=CC[n]1cccc1 Amb18203408 [1,0,0,0,1,0|2,0,0]=4 7771 B8R1.8 O=CCc1ccc[nH]1 Amb24763675 [1,0,0,0,1,0|2,0,0]=4 7772 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,1,0|2,0,0]=4 7773 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,1,0|2,0,0]=4 7774 B8R1.8 O=CCc1cocc1 Amb18641576 [1,0,0,0,1,0|2,0,0]=4 7775 B8R1.8 S=CNc1c[s]cc1 Amb24616004 [1,0,0,0,1,0|2,0,0]=4